1-[(3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-4-(2-methylpropyl)-1,4-diazepan-5-one

Systemtic Name: 1-[(3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-4-(2-methylpropyl)-1,4-diazepan-5-one Openeye Name: 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-isobutyl-1,4-diazepan-5-one CAS Name: 1-[(3,5-dimethyl-1H-pyrrol-2-yl)-oxomethyl]-4-(2-methylpropyl)-1,4-diazepan-5-one IUPAC Name: 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-(2-methylpropyl)-1,4-diazepan-5-one Traditional Name: 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-isobutyl-1,4-diazepan-5-one Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C(=O)N2CCC(=O)N(CC2)CC(C)C)C

Isomeric SMILES

CC1=CC(=C(N1)C(=O)N2CCC(=O)N(CC2)CC(C)C)C

InChI

InChI=1S/C16H25N3O2/c1-11(2)10-19-8-7-18(6-5-14(19)20)16(21)15-12(3)9-13(4)17-15/h9,11,17H,5-8,10H2,1-4H3