Vitas-M small molecule compound
methyl {[5-(3-chloro-1-benzothiophen-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STK807527
SMILES COC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1sc2c(c1Cl)cccc2
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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 C20H16ClN3O3S2 MW 445.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O3S2/c1-26-13-9-7-12(8-10-13)24-19(22-23-20(24)28-11-16(25)27-2)18-17(21)14-5-3-4-6-15(14)29-18/h3-10H,11H2,1-2H3InChIKey
DQTUTJWJAVHSCP-UHFFFAOYSA-NSynonyms
690246-54-9690246549
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)OC)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC20H16ClN3O3S2c126139712(81013)2419(222320(24)281116(25)272)1817(21)14534615(14)2918h310H11H212H3
methyl((5(3chloro1benzothiophen2yl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetate
METHYL2((5(3CHLORO1BENZOTHIOPHEN2YL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2((5(3CHLOROBENZO(B)THIOPHEN2YL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)THIO)ACETATE
METHYL2(5(3CHLOROBENZO(B)THIOPHEN2YL)4(4METHOXYPHENYL)124TRIAZOL3YLTHIO)ACETATE
MFCD04445503
ZINC000001058153
ZINC01058153
ZINC1058153
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