1-[5-(3-chlorophenyl)-6-(2-propylphenyl)-1,2,4-triazin-3-yl]pyrrolidin-3-one

Systemtic Name: 1-[5-(3-chlorophenyl)-6-(2-propylphenyl)-1,2,4-triazin-3-yl]pyrrolidin-3-one Openeye Name: 1-[5-(3-chlorophenyl)-6-(2-propylphenyl)-1,2,4-triazin-3-yl]pyrrolidin-3-one CAS Name: 1-[5-(3-chlorophenyl)-6-(2-propylphenyl)-1,2,4-triazin-3-yl]-3-pyrrolidinone IUPAC Name: 1-[5-(3-chlorophenyl)-6-(2-propylphenyl)-1,2,4-triazin-3-yl]pyrrolidin-3-one Traditional Name: 1-[5-(3-chlorophenyl)-6-(2-propylphenyl)-1,2,4-triazin-3-yl]-3-pyrrolidone Formula: C22H21ClN4O MolecularWeight: 392.88134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1C2=C(N=C(N=N2)N3CCC(=O)C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCC1=CC=CC=C1C2=C(N=C(N=N2)N3CCC(=O)C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN4O/c1-2-6-15-7-3-4-10-19(15)21-20(16-8-5-9-17(23)13-16)24-22(26-25-21)27-12-11-18(28)14-27/h3-5,7-10,13H,2,6,11-12,14H2,1H3