Vitas-M small molecule compound

2-amino-N-(4-phenylbutan-2-yl)-1-{[(E)-pyridin-4-ylmethylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK990838
SMILES CC(NC(=O)c1c2nc3ccccc3nc2n(c1N)/N=C/c1ccncc1)CCc1ccccc1

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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 C27H25N7O MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N7O/c1-18(11-12-19-7-3-2-4-8-19)31-27(35)23-24-26(33-22-10-6-5-9-21(22)32-24)34(25(23)28)30-17-20-13-15-29-16-14-20/h2-10,13-18H,11-12,28H2,1H3,(H,31,35)/b30-17+
InChIKey
ATNFGICNBHVQHN-OCSSWDANSA-N
Synonyms
840479-30-3
(E)2aminoN(4phenylbutan2yl)1((pyridin4ylmethylene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(4phenylbutan2yl)1(((E)pyridin4ylmethylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(4phenylbutan2yl)1((E)pyridin4ylmethylideneamino)pyrrolo(32b)quinoxaline3carboxamide
840479303
CC(CCC1=CC=CC=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=NC=C5)N
CC(NC(=O)c1c2nc3ccccc3nc2n(c1N)N=Cc1ccncc1)CCc1ccccc1
InChI=1SC27H25N7Oc118(1112197324819)3127(35)232426(33221065921(22)3224)34(25(23)28)301720131529161420h2101318H111228H21H3(H3135)b3017+
MFCD04006598
ZINC000002263744
ZINC000002263746

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Available files

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