Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methoxybenzyl)amino]phenyl (2E)-3-(4-methoxyphenyl)prop-2-enoate
Catalog ID
STK180076
SMILES COc1ccc(cc1)/C=C/C(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1ccc(cc1)OC
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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 C31H26N2O6S MW 554.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O6S/c1-37-25-14-7-22(8-15-25)11-20-30(34)39-27-18-12-24(13-19-27)33(21-23-9-16-26(38-2)17-10-23)31-28-5-3-4-6-29(28)40(35,36)32-31/h3-20H,21H2,1-2H3/b20-11+InChIKey
VKPJBYDVOFAREC-RGVLZGJSSA-NSynonyms
(4((11DIOXO12BENZOTHIAZOL3YL)((4METHOXYPHENYL)METHYL)AMINO)PHENYL)(E)3(4METHOXYPHENYL)PROP2ENOATE
4((11DIOXIDO12BENZOTHIAZOL3YL)(4METHOXYBENZYL)AMINO)PHENYL(2E)3(4METHOXYPHENYL)PROP2ENOATE
COC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC(=O)C=CC3=CC=C(C=C3)OC)C4=NS(=O)(=O)C5=CC=CC=C54
COc1ccc(cc1)C=CC(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1ccc(cc1)OC
InChI=1SC31H26N2O6Sc1372514722(81525)112030(34)3927181224(131927)33(212391626(382)171023)3128534629(28)40(3536)3231h320H21H212H3b2011+
MFCD06760134
ZINC000003642192
ZINC3642192
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