Vitas-M small molecule compound
N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-fluorobenzamide
Catalog ID
STK132098
SMILES O=C(NC1CCCCC1)CSc1sc2c(n1)ccc(c2)NC(=O)c1ccc(cc1)F
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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 C22H22FN3O2S2 MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN3O2S2/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
BLYQERXXTZBNPU-UHFFFAOYSA-NSynonyms
C1CCC(CC1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)F
InChI=1SC22H22FN3O2S2c23158614(7915)21(28)251710111819(1217)3022(2618)291320(27)24164213516h61216H1513H2(H2427)(H2528)
MFCD03877130
N(2((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)4FLUOROBENZAMIDE
N(2(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)4FLUOROBENZAMIDE
ZINC000000624640
ZINC00624640
ZINC624640
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