Vitas-M small molecule compound
ethyl 2-[({[4-(4-chlorophenyl)-1,3-thiazol-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK877869
SMILES CCOC(=O)c1c(NC(=O)CSc2scc(n2)c2ccc(cc2)Cl)sc2c1CCCC2
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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 C22H21ClN2O3S3 MW 493.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O3S3/c1-2-28-21(27)19-15-5-3-4-6-17(15)31-20(19)25-18(26)12-30-22-24-16(11-29-22)13-7-9-14(23)10-8-13/h7-11H,2-6,12H2,1H3,(H,25,26)InChIKey
PSSCMRKQCMGAHZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC(=CS3)C4=CC=C(C=C4)Cl
ethyl2((((4(4chlorophenyl)13thiazol2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2((4(4chlorophenyl)13thiazol2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H21ClN2O3S3c122821(27)1915534617(15)3120(19)2518(26)1230222416(112922)137914(23)10813h711H2612H21H3(H2526)
MFCD06099428
ZINC000016683090
ZINC16683090
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