Vitas-M small molecule compound
methyl 4-[({[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK580983
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1cccc(c1)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 C20H19ClN4O3S MW 430.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O3S/c1-3-25-18(14-5-4-6-15(21)11-14)23-24-20(25)29-12-17(26)22-16-9-7-13(8-10-16)19(27)28-2/h4-11H,3,12H2,1-2H3,(H,22,26)InChIKey
KBBFQIVJJGBCPT-UHFFFAOYSA-NSynonyms
862117-03-1862117031
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC(=CC=C3)Cl
InChI=1SC20H19ClN4O3Sc132518(1454615(21)1114)232420(25)291217(26)22169713(81016)19(27)282h411H312H212H3(H2226)
methyl4((((5(3chlorophenyl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((5(3CHLOROPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4(2((5(3CHLOROPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZOATE
methyl4(2((5(3chlorophenyl)4ethyl4H124triazol3yl)thio)acetamido)benzoate
METHYL4(2(5(3CHLOROPHENYL)4ETHYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
MFCD05687136
ZINC000009498437
ZINC09498437
ZINC9498437
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