Vitas-M small molecule compound
methyl 4-[({[5-(2-{[(4-chlorophenyl)carbonyl]amino}ethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK155917
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)CCNC(=O)c1ccc(cc1)Cl
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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 C22H22ClN5O4S MW 487.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O4S/c1-28-18(11-12-24-20(30)14-3-7-16(23)8-4-14)26-27-22(28)33-13-19(29)25-17-9-5-15(6-10-17)21(31)32-2/h3-10H,11-13H2,1-2H3,(H,24,30)(H,25,29)InChIKey
ZLLUKZOAPGFDNZ-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)CCNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC22H22ClN5O4Sc12818(11122420(30)143716(23)8414)262722(28)331319(29)25179515(61017)21(31)322h310H1113H212H3(H2430)(H2529)
METHYL4((((5(2(((4CHLOROPHENYL)CARBONYL)AMINO)ETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((((5(2((4CHLOROBENZOYL)AMINO)ETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5(2((4CHLOROBENZOYL)AMINO)ETHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD05112074
ZINC000002859276
ZINC02859276
ZINC2859276
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