Vitas-M small molecule compound
methyl 4-[({[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL347070
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)OC)nnc1c1ccc(cc1)OC
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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 C27H26N4O5S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O5S/c1-4-36-23-15-11-21(12-16-23)31-25(18-7-13-22(34-2)14-8-18)29-30-27(31)37-17-24(32)28-20-9-5-19(6-10-20)26(33)35-3/h5-16H,4,17H2,1-3H3,(H,28,32)InChIKey
HYNUONXUQNEIQB-UHFFFAOYSA-NSynonyms
849010-61-3849010613
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)OC)C4=CC=C(C=C4)OC
InChI=1SC27H26N4O5Sc143623151121(121623)3125(1871322(342)14818)293027(31)371724(32)28209519(61020)26(33)353h516H417H213H3(H2832)
methyl4((((4(4ethoxyphenyl)5(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((4(4ETHOXYPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4(2((4(4ETHOXYPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZOATE
methyl4(2((4(4ethoxyphenyl)5(4methoxyphenyl)4H124triazol3yl)thio)acetamido)benzoate
METHYL4(2(4(4ETHOXYPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
MFCD05680564
ZINC000002451215
ZINC02451215
ZINC2451215
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.