Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(thiophen-2-ylmethyl)amino]phenyl (4-methylphenoxy)acetate
Catalog ID
STL286994
SMILES O=C(Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1cccs1)COc1ccc(cc1)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 C27H22N2O5S2 MW 518.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O5S2/c1-19-8-12-21(13-9-19)33-18-26(30)34-22-14-10-20(11-15-22)29(17-23-5-4-16-35-23)27-24-6-2-3-7-25(24)36(31,32)28-27/h2-16H,17-18H2,1H3InChIKey
QNUOOVZBAJDYAR-UHFFFAOYSA-NSynonyms
(4((11dioxo12benzothiazol3yl)(thiophen2ylmethyl)amino)phenyl)2(4methylphenoxy)acetate
4((11dioxido12benzothiazol3yl)(thiophen2ylmethyl)amino)phenyl(4methylphenoxy)acetate
CC1=CC=C(C=C1)OCC(=O)OC2=CC=C(C=C2)N(CC3=CC=CS3)C4=NS(=O)(=O)C5=CC=CC=C54
InChI=1SC27H22N2O5S2c11981221(13919)331826(30)3422141020(111522)29(172354163523)2724623725(24)36(3132)2827h216H1718H21H3
MFCD24850172
ZINC000095481758
ZINC95481758
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