Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-2-methylpropyl 4-butoxybenzoate
Catalog ID
STK042173
SMILES CCCCOc1ccc(cc1)C(=O)OCC(NC1=NS(=O)(=O)c2c1cccc2)(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 C22H26N2O5S MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5S/c1-4-5-14-28-17-12-10-16(11-13-17)21(25)29-15-22(2,3)23-20-18-8-6-7-9-19(18)30(26,27)24-20/h6-13H,4-5,14-15H2,1-3H3,(H,23,24)InChIKey
JUMQIULJBGSOOG-UHFFFAOYSA-NSynonyms
(2((11DIOXO12BENZOTHIAZOL3YL)AMINO)2METHYLPROPYL)4BUTOXYBENZOATE
2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)2METHYLPROPYL4BUTOXYBENZOATE
CCCCOC1=CC=C(C=C1)C(=O)OCC(C)(C)NC2=NS(=O)(=O)C3=CC=CC=C32
CCCCOc1ccc(cc1)C(=O)OCC(NC1=NS(=O)(=O)c2c1cccc2)(C)C
InChI=1SC22H26N2O5Sc145142817121016(111317)21(25)291522(23)232018867919(18)30(2627)2420h613H451415H213H3(H2324)
MFCD01113476
STK042173
ZINC000002997575
ZINC02997575
ZINC2997575
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