1-(2-fluorophenyl)-4-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]carbonyl]pyrrolidin-2-one

Systemtic Name: 1-(2-fluorophenyl)-4-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]carbonyl]pyrrolidin-2-one Openeye Name: 1-(2-fluorophenyl)-4-[4-(2-thienylmethyl)-1,4-diazepane-1-carbonyl]pyrrolidin-2-one CAS Name: 1-(2-fluorophenyl)-4-[oxo-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-2-pyrrolidinone IUPAC Name: 1-(2-fluorophenyl)-4-[4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carbonyl]pyrrolidin-2-one Traditional Name: 1-(2-fluorophenyl)-4-[4-(2-thenyl)-1,4-diazepane-1-carbonyl]-2-pyrrolidone Formula: C21H24FN3O2S MolecularWeight: 401.497563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CC(=O)N(C2)C3=CC=CC=C3F)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CC(=O)N(C2)C3=CC=CC=C3F)CC4=CC=CS4

InChI

InChI=1S/C21H24FN3O2S/c22-18-6-1-2-7-19(18)25-14-16(13-20(25)26)21(27)24-9-4-8-23(10-11-24)15-17-5-3-12-28-17/h1-3,5-7,12,16H,4,8-11,13-15H2