Vitas-M small molecule compound
N-{2-[(4-tert-butyl-2,6-dimethylbenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-4-methoxybenzamide
Catalog ID
STK129672
SMILES COc1ccc(cc1)C(=O)Nc1ccc2c(c1)sc(n2)SCc1c(C)cc(cc1C)C(C)(C)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 C28H30N2O2S2 MW 490.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O2S2/c1-17-13-20(28(3,4)5)14-18(2)23(17)16-33-27-30-24-12-9-21(15-25(24)34-27)29-26(31)19-7-10-22(32-6)11-8-19/h7-15H,16H2,1-6H3,(H,29,31)InChIKey
XILVJBVWLSYPPD-UHFFFAOYSA-NSynonyms
CC1=CC(=CC(=C1CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)OC)C)C(C)(C)C
InChI=1SC28H30N2O2S2c1171320(28(34)5)1418(2)23(17)163327302412921(1525(24)3427)2926(31)1971022(326)11819h715H16H216H3(H2931)
MFCD04092386
N(2((4TERTBUTYL26DIMETHYLBENZYL)SULFANYL)13BENZOTHIAZOL6YL)4METHOXYBENZAMIDE
N(2((4TERTBUTYL26DIMETHYLPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)4METHOXYBENZAMIDE
ZINC000008438240
ZINC08438240
ZINC8438240
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