Vitas-M small molecule compound
methyl 3-{[({5-[(4-ethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK143751
SMILES CCc1ccc(cc1)OCc1nnc(n1C)SCC(=O)Nc1cccc(c1)C(=O)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 C22H24N4O4S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O4S/c1-4-15-8-10-18(11-9-15)30-13-19-24-25-22(26(19)2)31-14-20(27)23-17-7-5-6-16(12-17)21(28)29-3/h5-12H,4,13-14H2,1-3H3,(H,23,27)InChIKey
GESHJLMBVSETPC-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)OCC2=NN=C(N2C)SCC(=O)NC3=CC=CC(=C3)C(=O)OC
InChI=1SC22H24N4O4Sc141581018(11915)301319242522(26(19)2)311420(27)231775616(1217)21(28)293h512H41314H213H3(H2327)
METHYL3((((5((4ETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL3((((5((4ETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)THIO)ACETYL)AMINO)BENZOATE
METHYL3((2((5((4ETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL3(2(5((4ETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
MFCD03051483
ZINC000000682078
ZINC00682078
ZINC682078
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