5-(azepan-1-yl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-phenyl-thiophene-2-carboxamide

Systemtic Name: 5-(azepan-1-yl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-phenyl-thiophene-2-carboxamide Openeye Name: 5-(azepan-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-phenyl-thiophene-2-carboxamide CAS Name: 5-(1-azepanyl)-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-phenyl-2-thiophenecarboxamide IUPAC Name: 5-(azepan-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-phenylthiophene-2-carboxamide Traditional Name: 5-(azepan-1-yl)-N-[3-(2-ketopyrrolidino)propyl]-4-phenyl-thiophene-2-carboxamide Formula: C24H31N3O2S MolecularWeight: 425.58684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(S2)C(=O)NCCCN3CCCC3=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(S2)C(=O)NCCCN3CCCC3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H31N3O2S/c28-22-12-8-16-26(22)17-9-13-25-23(29)21-18-20(19-10-4-3-5-11-19)24(30-21)27-14-6-1-2-7-15-27/h3-5,10-11,18H,1-2,6-9,12-17H2,(H,25,29)