Vitas-M small molecule compound
(2E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide
Catalog ID
STK077761
SMILES N#C/C(=C\c1ccc(c(c1)O)O)/C(=O)Nc1nc2c(s1)cccc2
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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 C17H11N3O3S MW 337.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11N3O3S/c18-9-11(7-10-5-6-13(21)14(22)8-10)16(23)20-17-19-12-3-1-2-4-15(12)24-17/h1-8,21-22H,(H,19,20,23)/b11-7+InChIKey
PJWSGTLPGNRRQK-YRNVUSSQSA-NSynonyms
(2E)N(13BENZOTHIAZOL2YL)2CYANO3(34DIHYDROXYPHENYL)PROP2ENAMIDE
(E)N(13BENZOTHIAZOL2YL)2CYANO3(34DIHYDROXYPHENYL)PROP2ENAMIDE
C1=CC=C2C(=C1)N=C(S2)NC(=O)C(=CC3=CC(=C(C=C3)O)O)C#N
InChI=1SC17H11N3O3Sc18911(7105613(21)14(22)810)16(23)20171912312415(12)2417h182122H(H192023)b117+
MFCD05978667
N#CC(=Cc1ccc(c(c1)O)O)C(=O)Nc1nc2c(s1)cccc2
STK077761
ZINC000004670367
ZINC04670367
ZINC4670367
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