1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-4-(thiophen-2-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-4-(thiophen-2-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-[3-(2-oxopyrrolidin-1-yl)propyl]-4-(2-thienylmethyl)-1,4-diazepan-2-one CAS Name: 1-[3-(2-oxo-1-pyrrolidinyl)propyl]-6-phenylmethoxy-4-(thiophen-2-ylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-[3-(2-oxopyrrolidin-1-yl)propyl]-6-phenylmethoxy-4-(thiophen-2-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-[3-(2-ketopyrrolidino)propyl]-4-(2-thenyl)-1,4-diazepan-2-one Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2CC(CN(CC2=O)CC3=CC=CS3)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)CCCN2CC(CN(CC2=O)CC3=CC=CS3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H31N3O3S/c28-23-10-4-11-26(23)12-6-13-27-16-21(30-19-20-7-2-1-3-8-20)15-25(18-24(27)29)17-22-9-5-14-31-22/h1-3,5,7-9,14,21H,4,6,10-13,15-19H2