[4-(2-methylphenyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone

Systemtic Name: [4-(2-methylphenyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone Openeye Name: [4-(o-tolyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone CAS Name: [4-(2-methylphenyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone IUPAC Name: [4-(2-methylphenyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone Traditional Name: [4-(o-tolyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCCN(CC2)C(=O)C3=CNN=C3

Isomeric SMILES

CC1=CC=CC=C1N2CCCN(CC2)C(=O)C3=CNN=C3

InChI

InChI=1S/C16H20N4O/c1-13-5-2-3-6-15(13)19-7-4-8-20(10-9-19)16(21)14-11-17-18-12-14/h2-3,5-6,11-12H,4,7-10H2,1H3,(H,17,18)