1-methyl-4-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]carbonyl]pyridin-2-one

Systemtic Name: 1-methyl-4-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]carbonyl]pyridin-2-one Openeye Name: 1-methyl-4-[4-(2-thienylmethyl)-1,4-diazepane-1-carbonyl]pyridin-2-one CAS Name: 1-methyl-4-[oxo-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-2-pyridinone IUPAC Name: 1-methyl-4-[4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carbonyl]pyridin-2-one Traditional Name: 1-methyl-4-[4-(2-thenyl)-1,4-diazepane-1-carbonyl]-2-pyridone Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)C(=O)N2CCCN(CC2)CC3=CC=CS3

Isomeric SMILES

CN1C=CC(=CC1=O)C(=O)N2CCCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C17H21N3O2S/c1-18-8-5-14(12-16(18)21)17(22)20-7-3-6-19(9-10-20)13-15-4-2-11-23-15/h2,4-5,8,11-12H,3,6-7,9-10,13H2,1H3