Vitas-M small molecule compound

4-chloro-N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide

Catalog ID
STK858639
SMILES O=C(NC1CCCCC1)CSc1sc2c(n1)ccc(c2)NC(=O)c1ccc(cc1)Cl

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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 C22H22ClN3O2S2 MW 460.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O2S2/c23-15-8-6-14(7-9-15)21(28)25-17-10-11-18-19(12-17)30-22(26-18)29-13-20(27)24-16-4-2-1-3-5-16/h6-12,16H,1-5,13H2,(H,24,27)(H,25,28)
InChIKey
UPEUPOJMHFKXDT-UHFFFAOYSA-N
Synonyms
340971-42-8
340971428
4chloroN(2((2(cyclohexylamino)2oxoethyl)sulfanyl)13benzothiazol6yl)benzamide
4chloroN(2((2(cyclohexylamino)2oxoethyl)thio)benzo(d)thiazol6yl)benzamide
4CHLORON(2(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)BENZAMIDE
C1CCC(CC1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl
InChI=1SC22H22ClN3O2S2c23158614(7915)21(28)251710111819(1217)3022(2618)291320(27)24164213516h61216H1513H2(H2427)(H2528)
MFCD01420392
ZINC000002350153
ZINC02350153
ZINC2350153

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Available files

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