Vitas-M small molecule compound
(2E)-N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-3-phenylprop-2-enamide
Catalog ID
STL235218
SMILES CC(CCSc1nc2c(s1)cc(cc2)NC(=O)/C=C/c1ccccc1)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 C21H22N2OS2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2OS2/c1-15(2)12-13-25-21-23-18-10-9-17(14-19(18)26-21)22-20(24)11-8-16-6-4-3-5-7-16/h3-11,14-15H,12-13H2,1-2H3,(H,22,24)/b11-8+InChIKey
BLEAMJRNCLLJPE-DHZHZOJOSA-NSynonyms
843623-01-8(2E)N(2((3methylbutyl)sulfanyl)13benzothiazol6yl)3phenylprop2enamide
(E)N(2(3METHYLBUTYLSULFANYL)13BENZOTHIAZOL6YL)3PHENYLPROP2ENAMIDE
843623018
CC(C)CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C=CC3=CC=CC=C3
CC(CCSc1nc2c(s1)cc(cc2)NC(=O)C=Cc1ccccc1)C
InChI=1SC21H22N2OS2c115(2)12132521231810917(1419(18)2621)2220(24)118166435716h3111415H1213H212H3(H2224)b118+
MFCD04016594
N(2(isopentylthio)benzo(d)thiazol6yl)cinnamamide
ZINC000005047019
ZINC05047019
ZINC5047019
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