Vitas-M small molecule compound
2-{[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]methyl}phenyl benzoate
Catalog ID
STK180731
SMILES Cc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1ccccc1OC(=O)c1ccccc1
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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 C28H22N2O4S MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O4S/c1-20-15-17-23(18-16-20)30(27-24-12-6-8-14-26(24)35(32,33)29-27)19-22-11-5-7-13-25(22)34-28(31)21-9-3-2-4-10-21/h2-18H,19H2,1H3InChIKey
IKJVGOZWXKWXQY-UHFFFAOYSA-NSynonyms
(2((N(11DIOXO12BENZOTHIAZOL3YL)4METHYLANILINO)METHYL)PHENYL)BENZOATE
2(((11DIOXIDO12BENZISOTHIAZOL3YL)4METHYLANILINO)METHYL)PHENYLBENZOATE
2(((11DIOXIDO12BENZOTHIAZOL3YL)(4METHYLPHENYL)AMINO)METHYL)PHENYLBENZOATE
CC1=CC=C(C=C1)N(CC2=CC=CC=C2OC(=O)C3=CC=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54
InChI=1SC28H22N2O4Sc120151723(181620)30(272412681426(24)35(3233)2927)192211571325(22)3428(31)2193241021h218H19H21H3
MFCD03865364
ZINC000000643369
ZINC00643369
ZINC643369
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