Vitas-M small molecule compound

(2Z)-N-[2-(1H-benzimidazol-2-yl)ethyl]-3-(4-bromophenyl)-2-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}prop-2-enamide

Catalog ID
STL002926
SMILES Brc1ccc(cc1)/C=C(/C(=O)NCCc1nc2c([nH]1)cccc2)\NC(=O)/C=C/c1ccco1

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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 C25H21BrN4O3 MW 505.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN4O3/c26-18-9-7-17(8-10-18)16-22(30-24(31)12-11-19-4-3-15-33-19)25(32)27-14-13-23-28-20-5-1-2-6-21(20)29-23/h1-12,15-16H,13-14H2,(H,27,32)(H,28,29)(H,30,31)/b12-11+,22-16-
InChIKey
LSJFMBWPEBZQJV-CAZQFMQNSA-N
Synonyms
847183-01-1
(2Z)N(2(1Hbenzimidazol2yl)ethyl)3(4bromophenyl)2(((2E)3(furan2yl)prop2enoyl)amino)prop2enamide
(Z)N(2(1HBENZIMIDAZOL2YL)ETHYL)3(4BROMOPHENYL)2(((E)3(FURAN2YL)PROP2ENOYL)AMINO)PROP2ENAMIDE
(Z)N(2(1Hbenzo(d)imidazol2yl)ethyl)3(4bromophenyl)2((E)3(furan2yl)acrylamido)acrylamide
847183011
Brc1ccc(cc1)C=C(C(=O)NCCc1nc2c((nH)1)cccc2)NC(=O)C=Cc1ccco1
C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C(=CC3=CC=C(C=C3)Br)NC(=O)C=CC4=CC=CO4
InChI=1SC25H21BrN4O3c26189717(81018)1622(3024(31)12111943153319)25(32)271413232820512621(20)2923h1121516H1314H2(H2732)(H2829)(H3031)b1211+2216
MFCD04184541
ZINC000002398417
ZINC02398417
ZINC2398417

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Available files

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