Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 3-methylbenzoate
Catalog ID
STK137985
SMILES Cc1cccc(c1)C(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)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 C22H18N2O4S MW 406.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O4S/c1-15-6-5-7-16(14-15)22(25)28-18-12-10-17(11-13-18)24(2)21-19-8-3-4-9-20(19)29(26,27)23-21/h3-14H,1-2H3InChIKey
VXMRDOCVQIXWBW-UHFFFAOYSA-NSynonyms
(4((11dioxo12benzothiazol3yl)methylamino)phenyl)3methylbenzoate
4((11DIOXIDO12BENZOTHIAZOL3YL)(METHYL)AMINO)PHENYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N(C)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC22H18N2O4Sc11565716(1415)22(25)2818121017(111318)24(2)2119834920(19)29(2627)2321h314H12H3
MFCD01235020
ZINC000001060065
ZINC01060065
ZINC1060065
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