3-carbamimidoyl-N-[[5-oxidanylidene-1-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]pyrrolidin-3-yl]methyl]benzamide

Systemtic Name: 3-carbamimidoyl-N-[[5-oxidanylidene-1-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]pyrrolidin-3-yl]methyl]benzamide Openeye Name: 3-carbamimidoyl-N-[[5-oxo-1-[4-(2-oxo-1-piperidyl)phenyl]pyrrolidin-3-yl]methyl]benzamide CAS Name: 3-carbamimidoyl-N-[[5-oxo-1-[4-(2-oxo-1-piperidinyl)phenyl]-3-pyrrolidinyl]methyl]benzamide IUPAC Name: 3-carbamimidoyl-N-[[5-oxo-1-[4-(2-oxopiperidin-1-yl)phenyl]pyrrolidin-3-yl]methyl]benzamide Traditional Name: 3-amidino-N-[[5-keto-1-[4-(2-ketopiperidino)phenyl]pyrrolidin-3-yl]methyl]benzamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C24H27N5O3/c25-23(26)17-4-3-5-18(13-17)24(32)27-14-16-12-22(31)29(15-16)20-9-7-19(8-10-20)28-11-2-1-6-21(28)30/h3-5,7-10,13,16H,1-2,6,11-12,14-15H2,(H3,25,26)(H,27,32)