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

Systemtic Name: 3-carbamimidoyl-N-[[1-[4-(2-methyl-1-piperidin-1-yl-propan-2-yl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methyl]benzamide Openeye Name: 3-carbamimidoyl-N-[[1-[4-[1,1-dimethyl-2-(1-piperidyl)ethyl]phenyl]-5-oxo-pyrrolidin-3-yl]methyl]benzamide CAS Name: 3-carbamimidoyl-N-[[1-[4-[2-methyl-1-(1-piperidinyl)propan-2-yl]phenyl]-5-oxo-3-pyrrolidinyl]methyl]benzamide IUPAC Name: 3-carbamimidoyl-N-[[1-[4-(2-methyl-1-piperidin-1-ylpropan-2-yl)phenyl]-5-oxopyrrolidin-3-yl]methyl]benzamide Traditional Name: 3-amidino-N-[[1-[4-(1,1-dimethyl-2-piperidino-ethyl)phenyl]-5-keto-pyrrolidin-3-yl]methyl]benzamide Formula: C28H37N5O2 MolecularWeight: 475.62568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCCCC1)C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC(C)(CN1CCCCC1)C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C28H37N5O2/c1-28(2,19-32-13-4-3-5-14-32)23-9-11-24(12-10-23)33-18-20(15-25(33)34)17-31-27(35)22-8-6-7-21(16-22)26(29)30/h6-12,16,20H,3-5,13-15,17-19H2,1-2H3,(H3,29,30)(H,31,35)