Vitas-M small molecule compound
methyl 4-[({[4-amino-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL228747
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1ccccc1C
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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 C19H19N5O3S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O3S/c1-12-5-3-4-6-15(12)17-22-23-19(24(17)20)28-11-16(25)21-14-9-7-13(8-10-14)18(26)27-2/h3-10H,11,20H2,1-2H3,(H,21,25)InChIKey
DMEJWXYIOCPAID-UHFFFAOYSA-NSynonyms
578737-00-5578737005
CC1=CC=CC=C1C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC19H19N5O3Sc112534615(12)17222319(24(17)20)281116(25)21149713(81014)18(26)272h310H1120H212H3(H2125)
methyl4((((4amino5(2methylphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((4AMINO5(2METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((4amino5(otolyl)4H124triazol3yl)thio)acetamido)benzoate
MFCD04031890
ZINC000002394883
ZINC02394883
ZINC2394883
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