Vitas-M small molecule compound

2-amino-1-{[(E)-(3-methylphenyl)methylidene]amino}-N-(3-phenylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK920727
SMILES Cc1cccc(c1)/C=N/n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCCc1ccccc1

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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 C28H26N6O MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N6O/c1-19-9-7-12-21(17-19)18-31-34-26(29)24(25-27(34)33-23-15-6-5-14-22(23)32-25)28(35)30-16-8-13-20-10-3-2-4-11-20/h2-7,9-12,14-15,17-18H,8,13,16,29H2,1H3,(H,30,35)/b31-18+
InChIKey
PJRNDBVGUVPZRG-FDAWAROLSA-N
Synonyms
578004-01-0
(E)2amino1((3methylbenzylidene)amino)N(3phenylpropyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(3methylphenyl)methylidene)amino)N(3phenylpropyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(3METHYLPHENYL)METHYLIDENEAMINO)N(3PHENYLPROPYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
578004010
CC1=CC=CC(=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCCC5=CC=CC=C5)N
Cc1cccc(c1)C=Nn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCCc1ccccc1
InChI=1SC28H26N6Oc119971221(1719)18313426(29)24(2527(34)332315651422(23)3225)28(35)301681320103241120h2791214151718H8131629H21H3(H3035)b3118+
MFCD04023712
ZINC000002369478
ZINC2369477

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Available files

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