Vitas-M small molecule compound

1-{[4-(acetylamino)phenyl]sulfonyl}-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]piperidine-4-carboxamide

Catalog ID
STK639529
SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)/N=c\1/sc2c([nH]1)cccc2

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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 C21H22N4O4S2 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S2/c1-14(26)22-16-6-8-17(9-7-16)31(28,29)25-12-10-15(11-13-25)20(27)24-21-23-18-4-2-3-5-19(18)30-21/h2-9,15H,10-13H2,1H3,(H,22,26)(H,23,24,27)
InChIKey
UGXJVSSTBIEXOM-UHFFFAOYSA-N
Synonyms
1010939-18-0
1((4(acetylamino)phenyl)sulfonyl)N((2E)13benzothiazol2(3H)ylidene)piperidine4carboxamide
1(4acetamidophenyl)sulfonylN(13benzothiazol2yl)piperidine4carboxamide
1010939180
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4S3
CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N=c1sc2c((nH)1)cccc2
InChI=1SC21H22N4O4S2c114(26)22166817(9716)31(2829)25121015(111325)20(27)24212318423519(18)3021h2915H1013H21H3(H2226)(H232427)
MFCD18162028
ZINC000012389480
ZINC12389480
ZINC49937740

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Available files

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