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

Systemtic Name: ethyl 2-[3-ethyl-5-oxidanylidene-4-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-(benzylamino)-3-ethyl-5-oxo-1,2,4-triazol-1-yl]acetate CAS Name: 2-[3-ethyl-5-oxo-4-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(benzylamino)-3-ethyl-5-oxo-1,2,4-triazol-1-yl]acetate Traditional Name: 2-[4-(benzylamino)-3-ethyl-5-keto-1,2,4-triazol-1-yl]acetic acid ethyl ester Formula: C15H20N4O3 MolecularWeight: 304.3443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O3/c1-3-13-17-18(11-14(20)22-4-2)15(21)19(13)16-10-12-8-6-5-7-9-12/h5-9,16H,3-4,10-11H2,1-2H3