ethyl 2-[3-ethyl-4-[(4-methylphenyl)methylamino]-5-oxidanylidene-1,2,4-triazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-ethyl-4-[(4-methylphenyl)methylamino]-5-oxidanylidene-1,2,4-triazol-1-yl]ethanoate Openeye Name: ethyl 2-[3-ethyl-5-oxo-4-(p-tolylmethylamino)-1,2,4-triazol-1-yl]acetate CAS Name: 2-[3-ethyl-4-[(4-methylphenyl)methylamino]-5-oxo-1,2,4-triazol-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-ethyl-4-[(4-methylphenyl)methylamino]-5-oxo-1,2,4-triazol-1-yl]acetate Traditional Name: 2-[3-ethyl-5-keto-4-[(4-methylbenzyl)amino]-1,2,4-triazol-1-yl]acetic acid ethyl ester Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)N1NCC2=CC=C(C=C2)C)CC(=O)OCC

Isomeric SMILES

CCC1=NN(C(=O)N1NCC2=CC=C(C=C2)C)CC(=O)OCC

InChI

InChI=1S/C16H22N4O3/c1-4-14-18-19(11-15(21)23-5-2)16(22)20(14)17-10-13-8-6-12(3)7-9-13/h6-9,17H,4-5,10-11H2,1-3H3