Vitas-M small molecule compound
methyl 4-{[({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STL061950
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC)COc1ccc(cc1)C
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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/c1-4-26-19(13-30-18-11-5-15(2)6-12-18)24-25-22(26)31-14-20(27)23-17-9-7-16(8-10-17)21(28)29-3/h5-12H,4,13-14H2,1-3H3,(H,23,27)InChIKey
QPYAGDOIKOYFAY-UHFFFAOYSA-NSynonyms
849826-07-9849826079
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)COC3=CC=C(C=C3)C
InChI=1SC22H24N4O4Sc142619(13301811515(2)61218)242522(26)311420(27)23179716(81017)21(28)293h512H41314H213H3(H2327)
methyl4((((4ethyl5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((4ETHYL5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((4ethyl5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamido)benzoate
METHYL4(2((4ETHYL5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZOATE
METHYL4(2(4ETHYL5((4METHYLPHENOXY)METHYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
MFCD05688122
ZINC000009499812
ZINC09499812
ZINC9499812
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