4-[(2-chlorophenyl)methyl]-1-(2-methylpyrazol-3-yl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(2-chlorophenyl)methyl]-1-(2-methylpyrazol-3-yl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-[(2-chlorophenyl)methyl]-1-(2-methylpyrazole-3-carbonyl)-1,4-diazepan-5-one CAS Name: 4-[(2-chlorophenyl)methyl]-1-[(2-methyl-3-pyrazolyl)-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-chlorophenyl)methyl]-1-(2-methylpyrazole-3-carbonyl)-1,4-diazepan-5-one Traditional Name: 4-(2-chlorobenzyl)-1-(2-methylpyrazole-3-carbonyl)-1,4-diazepan-5-one Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)N2CCC(=O)N(CC2)CC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=CC=N1)C(=O)N2CCC(=O)N(CC2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C17H19ClN4O2/c1-20-15(6-8-19-20)17(24)21-9-7-16(23)22(11-10-21)12-13-4-2-3-5-14(13)18/h2-6,8H,7,9-12H2,1H3