Vitas-M small molecule compound

4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methoxybenzyl)amino]phenyl 4-(piperidin-1-ylsulfonyl)benzoate

Catalog ID
STK181144
SMILES COc1ccc(cc1)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)OC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

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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 C33H31N3O7S2 MW 645.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O7S2/c1-42-27-15-9-24(10-16-27)23-36(32-30-7-3-4-8-31(30)44(38,39)34-32)26-13-17-28(18-14-26)43-33(37)25-11-19-29(20-12-25)45(40,41)35-21-5-2-6-22-35/h3-4,7-20H,2,5-6,21-23H2,1H3
InChIKey
QDEIDVSAQOVPMH-UHFFFAOYSA-N
Synonyms

(4((11DIOXO12BENZOTHIAZOL3YL)((4METHOXYPHENYL)METHYL)AMINO)PHENYL)4PIPERIDIN1YLSULFONYLBENZOATE
4((11DIOXIDO12BENZOTHIAZOL3YL)(4METHOXYBENZYL)AMINO)PHENYL4(PIPERIDIN1YLSULFONYL)BENZOATE
COC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=NS(=O)(=O)C6=CC=CC=C65
InChI=1SC33H31N3O7S2c1422715924(101627)2336(3230734831(30)44(3839)3432)26131728(181426)4333(37)25111929(201225)45(4041)35215262235h34720H2562123H21H3
MFCD05149519
ZINC000033354131
ZINC33354131

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Available files

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