3-[[(4-carbamimidoylphenyl)carbonylamino]methyl]-N-(3,3-diphenylpropyl)piperidine-1-carboxamide

Systemtic Name: 3-[[(4-carbamimidoylphenyl)carbonylamino]methyl]-N-(3,3-diphenylpropyl)piperidine-1-carboxamide Openeye Name: 3-[[(4-carbamimidoylbenzoyl)amino]methyl]-N-(3,3-diphenylpropyl)piperidine-1-carboxamide CAS Name: 3-[[[(4-carbamimidoylphenyl)-oxomethyl]amino]methyl]-N-(3,3-diphenylpropyl)-1-piperidinecarboxamide IUPAC Name: 3-[[(4-carbamimidoylbenzoyl)amino]methyl]-N-(3,3-diphenylpropyl)piperidine-1-carboxamide Traditional Name: 3-[[(4-amidinobenzoyl)amino]methyl]-N-(3,3-diphenylpropyl)piperidine-1-carboxamide Formula: C30H35N5O2 MolecularWeight: 497.6312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)CNC(=O)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CC(CN(C1)C(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)CNC(=O)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C30H35N5O2/c31-28(32)25-13-15-26(16-14-25)29(36)34-20-22-8-7-19-35(21-22)30(37)33-18-17-27(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,22,27H,7-8,17-21H2,(H3,31,32)(H,33,37)(H,34,36)