N-[4-(azepan-1-ylsulfonyl)phenyl]-5-oxidanylidene-pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-oxo-pyrrolidine-2-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-oxopyrrolidine-2-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-keto-pyrrolidine-2-carboxamide Formula: C17H23N3O4S MolecularWeight: 365.44722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCC(=O)N3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCC(=O)N3

InChI

InChI=1S/C17H23N3O4S/c21-16-10-9-15(19-16)17(22)18-13-5-7-14(8-6-13)25(23,24)20-11-3-1-2-4-12-20/h5-8,15H,1-4,9-12H2,(H,18,22)(H,19,21)