Vitas-M small molecule compound
N-{4-[5-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]phenyl}-2-methoxybenzamide
Catalog ID
STL357655
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1OC
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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 C27H27N5O4S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4S/c1-4-36-21-15-13-19(14-16-21)28-24(33)17-37-27-31-30-25(32(27)2)18-9-11-20(12-10-18)29-26(34)22-7-5-6-8-23(22)35-3/h5-16H,4,17H2,1-3H3,(H,28,33)(H,29,34)InChIKey
KVHXJMNKSDPBMP-UHFFFAOYSA-NSynonyms
444117-51-5444117515
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4OC
InChI=1SC27H27N5O4Sc143621151319(141621)2824(33)173727313025(32(27)2)1891120(121018)2926(34)22756823(22)353h516H417H213H3(H2833)(H2934)
MFCD02951523
N(4(5((2((4ethoxyphenyl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)phenyl)2methoxybenzamide
N(4(5((2((4ethoxyphenyl)amino)2oxoethyl)thio)4methyl4H124triazol3yl)phenyl)2methoxybenzamide
N(4(5((2(4ETHOXYANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)2METHOXYBENZAMIDE
N(4(5(2(4ETHOXYANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PHENYL)2METHOXYBENZAMIDE
ZINC000000680501
ZINC00680501
ZINC680501
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