1-[(5-methyl-1H-pyrazol-3-yl)carbonyl]-4-(naphthalen-2-ylmethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[(5-methyl-1H-pyrazol-3-yl)carbonyl]-4-(naphthalen-2-ylmethyl)-1,4-diazepan-5-one Openeye Name: 1-(5-methyl-1H-pyrazole-3-carbonyl)-4-(2-naphthylmethyl)-1,4-diazepan-5-one CAS Name: 1-[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]-4-(2-naphthalenylmethyl)-1,4-diazepan-5-one IUPAC Name: 1-(5-methyl-1H-pyrazole-3-carbonyl)-4-(naphthalen-2-ylmethyl)-1,4-diazepan-5-one Traditional Name: 1-(5-methyl-1H-pyrazole-3-carbonyl)-4-(2-naphthylmethyl)-1,4-diazepan-5-one Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)N2CCC(=O)N(CC2)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=NN1)C(=O)N2CCC(=O)N(CC2)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H22N4O2/c1-15-12-19(23-22-15)21(27)24-9-8-20(26)25(11-10-24)14-16-6-7-17-4-2-3-5-18(17)13-16/h2-7,12-13H,8-11,14H2,1H3,(H,22,23)