Vitas-M small molecule compound

2-butyl-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK101877
SMILES CCCCc1c(C)c(C#N)c2n(c1Nc1c(=O)n(n(c1C)C)c1ccccc1)c1ccccc1n2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C28H28N6O MW 464.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O/c1-5-6-14-21-18(2)22(17-29)27-30-23-15-10-11-16-24(23)33(27)26(21)31-25-19(3)32(4)34(28(25)35)20-12-8-7-9-13-20/h7-13,15-16,31H,5-6,14H2,1-4H3
InChIKey
HIOSYSIOXSGMQH-UHFFFAOYSA-N
Synonyms
384800-97-9
(1E)2BUTYL1((15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)IMINO)3METHYL15DIHYDROPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2BUTYL1((15DIMETHYL3OXIDANYLIDENE2PHENYLPYRAZOL4YL)AMINO)3METHYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2BUTYL1((15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)AMINO)3METHYLBENZO(45)IMIDAZO(12A)PYRIDINE4CARBONITRILE
2BUTYL1((15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)AMINO)3METHYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2BUTYL1((15DIMETHYL3OXO2PHENYL4PYRAZOLYL)AMINO)3METHYL4PYRIDO(12A)BENZIMIDAZOLECARBONITRILE
2BUTYL1((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)3METHYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2BUTYL1((3KETO15DIMETHYL2PHENYL3PYRAZOLIN4YL)AMINO)3METHYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2BUTYL1(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YLAMINO)3METHYLBENZO(45)IMIDAZO(12A)PYRIDINE4CARBONITRILE
384800979
4((23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))AMINO)3BUTYL2METHYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
CCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C
InChI=1SC28H28N6Oc156142118(2)22(1729)2730231510111624(23)33(27)26(21)312519(3)32(4)34(28(25)35)20128791320h713151631H5614H214H3
MFCD03284474
ZINC000008836500
ZINC08836500
ZINC102924759
ZINC8836500

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Available files

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