ethyl 2-[(5S)-5-(2-methylpropyl)-6-oxidanylidene-3-phenyl-2,5-dihydro-1,2,4-triazin-1-yl]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[(5S)-5-(2-methylpropyl)-6-oxidanylidene-3-phenyl-2,5-dihydro-1,2,4-triazin-1-yl]-3-phenyl-propanoate Openeye Name: ethyl 2-[(5S)-5-isobutyl-6-oxo-3-phenyl-2,5-dihydro-1,2,4-triazin-1-yl]-3-phenyl-propanoate CAS Name: 2-[(5S)-5-(2-methylpropyl)-6-oxo-3-phenyl-2,5-dihydro-1,2,4-triazin-1-yl]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[(5S)-5-(2-methylpropyl)-6-oxo-3-phenyl-2,5-dihydro-1,2,4-triazin-1-yl]-3-phenylpropanoate Traditional Name: 2-[(5S)-5-isobutyl-6-keto-3-phenyl-2,5-dihydro-1,2,4-triazin-1-yl]-3-phenyl-propionic acid ethyl ester Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)N2C(=O)C(N=C(N2)C3=CC=CC=C3)CC(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)N2C(=O)[C@@H](N=C(N2)C3=CC=CC=C3)CC(C)C

InChI

InChI=1S/C24H29N3O3/c1-4-30-24(29)21(16-18-11-7-5-8-12-18)27-23(28)20(15-17(2)3)25-22(26-27)19-13-9-6-10-14-19/h5-14,17,20-21H,4,15-16H2,1-3H3,(H,25,26)/t20-,21?/m0/s1