Vitas-M small molecule compound
(2E)-3-(2-{2-[(4-chlorophenyl)sulfanyl]ethoxy}phenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide
Catalog ID
STK385457
SMILES N#C/C(=C\c1ccccc1OCCSc1ccc(cc1)Cl)/C(=O)Nc1cccc(c1)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 C25H21ClN2O2S MW 448.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O2S/c1-18-5-4-7-22(15-18)28-25(29)20(17-27)16-19-6-2-3-8-24(19)30-13-14-31-23-11-9-21(26)10-12-23/h2-12,15-16H,13-14H2,1H3,(H,28,29)/b20-16+InChIKey
WYZRDQMMCDJLAM-CAPFRKAQSA-NSynonyms
(2E)3(2(2((4CHLOROPHENYL)SULFANYL)ETHOXY)PHENYL)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
(2E)3(2(2(4CHLOROPHENYLTHIO)ETHOXY)PHENYL)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
(E)3(2(2(4CHLOROPHENYL)SULFANYLETHOXY)PHENYL)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
CC1=CC(=CC=C1)NC(=O)C(=CC2=CC=CC=C2OCCSC3=CC=C(C=C3)Cl)C#N
InChI=1SC25H21ClN2O2Sc11854722(1518)2825(29)20(1727)1619623824(19)301314312311921(26)101223h2121516H1314H21H3(H2829)b2016+
MFCD02067661
N#CC(=Cc1ccccc1OCCSc1ccc(cc1)Cl)C(=O)Nc1cccc(c1)C
ZINC000016157721
ZINC16157721
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