propan-2-yl 2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(5-methyl-2-phenyltriazole-4-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]-4-(methylthio)butyric acid isopropyl ester Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC(CCSC)C(=O)OC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(N=C1C(=O)NC(CCSC)C(=O)OC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C18H24N4O3S/c1-12(2)25-18(24)15(10-11-26-4)19-17(23)16-13(3)20-22(21-16)14-8-6-5-7-9-14/h5-9,12,15H,10-11H2,1-4H3,(H,19,23)