Vitas-M small molecule compound
4-(decyloxy)-N-(2-{[4-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)benzyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Catalog ID
STK673649
SMILES CCCCCCCCCCOc1ccc(cc1)C(=O)Nc1ccc2c(c1)sc(n2)SCc1ccc(cc1)SCC(=O)NCCc1ccccc1
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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 C41H47N3O3S3 MW 726.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H47N3O3S3/c1-2-3-4-5-6-7-8-12-27-47-35-20-17-33(18-21-35)40(46)43-34-19-24-37-38(28-34)50-41(44-37)49-29-32-15-22-36(23-16-32)48-30-39(45)42-26-25-31-13-10-9-11-14-31/h9-11,13-24,28H,2-8,12,25-27,29-30H2,1H3,(H,42,45)(H,43,46)InChIKey
JRVJLJDNUQBNQQ-UHFFFAOYSA-NSynonyms
4(decyloxy)N(2((4((2oxo2((2phenylethyl)amino)ethyl)sulfanyl)benzyl)sulfanyl)13benzothiazol6yl)benzamide
4decoxyN(2((4(2oxo2(2phenylethylamino)ethyl)sulfanylphenyl)methylsulfanyl)13benzothiazol6yl)benzamide
4DECOXYN(2((4(2OXO2(PHENETHYLAMINO)ETHYL)SULFANYLPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)BENZAMIDE
CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C=C4)SCC(=O)NCCC5=CC=CC=C5
InChI=1SC41H47N3O3S3c1234567812274735201733(182135)40(46)433419243738(2834)5041(4437)492932152236(231632)483039(45)4226253113109111431h911132428H281225272930H21H3(H4245)(H4346)
MFCD01304300
ZINC000098002596
ZINC98002596
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