Vitas-M small molecule compound
2-{[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]methyl}phenyl pyridine-3-carboxylate
Catalog ID
STK181092
SMILES Cc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1ccccc1OC(=O)c1cccnc1
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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 C27H21N3O4S MW 483.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4S/c1-19-12-14-22(15-13-19)30(26-23-9-3-5-11-25(23)35(32,33)29-26)18-21-7-2-4-10-24(21)34-27(31)20-8-6-16-28-17-20/h2-17H,18H2,1H3InChIKey
NZNUBCLBJSREGO-UHFFFAOYSA-NSynonyms
(2((N(11DIOXO12BENZOTHIAZOL3YL)4METHYLANILINO)METHYL)PHENYL)PYRIDINE3CARBOXYLATE
2(((11DIOXIDO12BENZISOTHIAZOL3YL)4METHYLANILINO)METHYL)PHENYLNICOTINATE
2(((11DIOXIDO12BENZOTHIAZOL3YL)(4METHYLPHENYL)AMINO)METHYL)PHENYLPYRIDINE3CARBOXYLATE
CC1=CC=C(C=C1)N(CC2=CC=CC=C2OC(=O)C3=CN=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54
InChI=1SC27H21N3O4Sc119121422(151319)30(26239351125(23)35(3233)2926)18217241024(21)3427(31)208616281720h217H18H21H3
MFCD04090412
ZINC000000681979
ZINC00681979
ZINC681979
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