Vitas-M small molecule compound
4-butoxy-N-[2-({2-[(5-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide
Catalog ID
STK673985
SMILES CCCCOc1ccc(cc1)C(=O)Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1cc(Cl)ccc1C
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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 C27H26ClN3O3S2 MW 540.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S2/c1-3-4-13-34-21-10-6-18(7-11-21)26(33)29-20-9-12-22-24(15-20)36-27(31-22)35-16-25(32)30-23-14-19(28)8-5-17(23)2/h5-12,14-15H,3-4,13,16H2,1-2H3,(H,29,33)(H,30,32)InChIKey
NMIYAJOQDATYCX-UHFFFAOYSA-NSynonyms
4BUTOXYN(2((2((5CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)BENZAMIDE
4BUTOXYN(2(2(5CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)BENZAMIDE
CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=C(C=CC(=C4)Cl)C
InChI=1SC27H26ClN3O3S2c13413342110618(71121)26(33)29209122224(1520)3627(3122)351625(32)30231419(28)8517(23)2h5121415H341316H212H3(H2933)(H3032)
MFCD01303988
ZINC000003664768
ZINC3664768
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