3-[(3-ethanoylphenyl)amino]-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[(3-ethanoylphenyl)amino]-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-(3-acetylanilino)-6-[(4-isopropylphenyl)methyl]-2H-1,2,4-triazin-5-one CAS Name: 3-(3-acetylanilino)-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-(3-acetylanilino)-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one Traditional Name: 3-(3-acetylanilino)-6-(4-isopropylbenzyl)-2H-1,2,4-triazin-5-one Formula: C21H22N4O2 MolecularWeight: 362.42498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H22N4O2/c1-13(2)16-9-7-15(8-10-16)11-19-20(27)23-21(25-24-19)22-18-6-4-5-17(12-18)14(3)26/h4-10,12-13H,11H2,1-3H3,(H2,22,23,25,27)