Vitas-M small molecule compound
2-{[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Catalog ID
STK807312
SMILES COc1ccc2c(c1)sc(c2Cl)c1nnc(n1C)SCC(=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 C20H15Cl2N3O2S2 MW 464.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2N3O2S2/c1-25-19(18-17(22)14-8-7-13(27-2)9-16(14)29-18)23-24-20(25)28-10-15(26)11-3-5-12(21)6-4-11/h3-9H,10H2,1-2H3InChIKey
FZCXDEPYWVYENQ-UHFFFAOYSA-NSynonyms
2((5(3CHLORO6METHOXY1BENZOTHIOPHEN2YL)4METHYL124TRIAZOL3YL)SULFANYL)1(4CHLOROPHENYL)ETHANONE
2((5(3chloro6methoxy1benzothiophen2yl)4methyl4H124triazol3yl)sulfanyl)1(4chlorophenyl)ethanone
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=C(C4=C(S3)C=C(C=C4)OC)Cl
InChI=1SC20H15Cl2N3O2S2c12519(1817(22)148713(272)916(14)2918)232420(25)281015(26)113512(21)6411h39H10H212H3
MFCD04442794
ZINC000002696140
ZINC02696140
ZINC2696140
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