3-(3-chlorophenyl)-5-(phenylmethyl)-1-(1-piperidin-1-ylethyl)-1,2,4-triazin-6-one

Systemtic Name: 3-(3-chlorophenyl)-5-(phenylmethyl)-1-(1-piperidin-1-ylethyl)-1,2,4-triazin-6-one Openeye Name: 5-benzyl-3-(3-chlorophenyl)-1-[1-(1-piperidyl)ethyl]-1,2,4-triazin-6-one CAS Name: 3-(3-chlorophenyl)-5-(phenylmethyl)-1-[1-(1-piperidinyl)ethyl]-1,2,4-triazin-6-one IUPAC Name: 5-benzyl-3-(3-chlorophenyl)-1-(1-piperidin-1-ylethyl)-1,2,4-triazin-6-one Traditional Name: 5-benzyl-3-(3-chlorophenyl)-1-(1-piperidinoethyl)-1,2,4-triazin-6-one Formula: C23H25ClN4O MolecularWeight: 408.9238

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCCC1)N2C(=O)C(=NC(=N2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC(N1CCCCC1)N2C(=O)C(=NC(=N2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C23H25ClN4O/c1-17(27-13-6-3-7-14-27)28-23(29)21(15-18-9-4-2-5-10-18)25-22(26-28)19-11-8-12-20(24)16-19/h2,4-5,8-12,16-17H,3,6-7,13-15H2,1H3