Vitas-M small molecule compound
(2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)prop-2-enenitrile
Catalog ID
STK535852
SMILES N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1cccc(c1)Br
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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 C28H21BrClN3O4S MW 610.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrClN3O4S/c1-35-24-10-17(11-25(36-2)27(24)37-3)26(34)21-12-20(30)7-8-22(21)32-14-18(13-31)28-33-23(15-38-28)16-5-4-6-19(29)9-16/h4-12,14-15,32H,1-3H3/b18-14+InChIKey
DMKXETZSLMTCCR-NBVRZTHBSA-NSynonyms
(2E)2(4(3bromophenyl)13thiazol2yl)3((4chloro2((345trimethoxyphenyl)carbonyl)phenyl)amino)prop2enenitrile
(E)2(4(3BROMOPHENYL)13THIAZOL2YL)3(4CHLORO2(345TRIMETHOXYBENZOYL)ANILINO)PROP2ENENITRILE
(E)2(4(3bromophenyl)thiazol2yl)3((4chloro2(345trimethoxybenzoyl)phenyl)amino)acrylonitrile
COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(C=CC(=C2)Cl)NC=C(C#N)C3=NC(=CS3)C4=CC(=CC=C4)Br
InChI=1SC28H21BrClN3O4Sc135241017(1125(362)27(24)373)26(34)211220(30)7822(21)321418(1331)283323(153828)1654619(29)916h412141532H13H3b1814+
MFCD02982346
N#CC(=CNc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)c1scc(n1)c1cccc(c1)Br
ZINC000097966521
ZINC97966521
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