Vitas-M small molecule compound
2-{(E)-2-[4-methoxy-3-(piperidin-1-ylsulfonyl)phenyl]ethenyl}-1,3-benzothiazole
Catalog ID
STK807835
SMILES COc1ccc(cc1S(=O)(=O)N1CCCCC1)/C=C/c1nc2c(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 C21H22N2O3S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S2/c1-26-18-11-9-16(10-12-21-22-17-7-3-4-8-19(17)27-21)15-20(18)28(24,25)23-13-5-2-6-14-23/h3-4,7-12,15H,2,5-6,13-14H2,1H3/b12-10+InChIKey
TXFRZEUDPYLRAI-ZRDIBKRKSA-NSynonyms
((5((1E)2BENZOTHIAZOL2YLVINYL)2METHOXYPHENYL)SULFONYL)PIPERIDINE
(E)2(4METHOXY3(PIPERIDIN1YLSULFONYL)STYRYL)BENZO(D)THIAZOLE
2((E)2(4methoxy3(piperidin1ylsulfonyl)phenyl)ethenyl)13benzothiazole
2((E)2(4METHOXY3PIPERIDIN1YLSULFONYLPHENYL)ETHENYL)13BENZOTHIAZOLE
COC1=C(C=C(C=C1)C=CC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4
COc1ccc(cc1S(=O)(=O)N1CCCCC1)C=Cc1nc2c(s1)cccc2
InChI=1SC21H22N2O3S2c1261811916(1012212217734819(17)2721)1520(18)28(2425)23135261423h3471215H2561314H21H3b1210+
MFCD06407541
ZINC000004942373
ZINC04942373
ZINC4942373
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