Vitas-M small molecule compound

2-amino-N-[2-(cyclohex-1-en-1-yl)ethyl]-1-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK920806
SMILES CN(c1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCCC1=CCCCC1)C

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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 C28H31N7O MW 481.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N7O/c1-34(2)21-14-12-20(13-15-21)18-31-35-26(29)24(28(36)30-17-16-19-8-4-3-5-9-19)25-27(35)33-23-11-7-6-10-22(23)32-25/h6-8,10-15,18H,3-5,9,16-17,29H2,1-2H3,(H,30,36)/b31-18+
InChIKey
LMJZGKYDJAFLFM-FDAWAROLSA-N
Synonyms
578757-53-6
(E)2aminoN(2(cyclohex1en1yl)ethyl)1((4(dimethylamino)benzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(2(cyclohex1en1yl)ethyl)1(((E)(4(dimethylamino)phenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(2(cyclohexen1yl)ethyl)1((E)(4(dimethylamino)phenyl)methylideneamino)pyrrolo(32b)quinoxaline3carboxamide
578757536
CN(C)C1=CC=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CCCCC5)N
CN(c1ccc(cc1)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCCC1=CCCCC1)C
InChI=1SC28H31N7Oc134(2)21141220(131521)18313526(29)24(28(36)301716198435919)2527(35)332311761022(23)3225h68101518H359161729H212H3(H3036)b3118+
MFCD04025656
ZINC000002374341
ZINC33363992

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Available files

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