(1S,2S)-N1-[(4-carbamimidoylphenyl)methyl]-N2-(phenylmethyl)cyclopentane-1,2-dicarboxamide

Systemtic Name: (1S,2S)-N1-[(4-carbamimidoylphenyl)methyl]-N2-(phenylmethyl)cyclopentane-1,2-dicarboxamide Openeye Name: (1S,2S)-N2-benzyl-N1-[(4-carbamimidoylphenyl)methyl]cyclopentane-1,2-dicarboxamide CAS Name: (1S,2S)-N1-[(4-carbamimidoylphenyl)methyl]-N2-(phenylmethyl)cyclopentane-1,2-dicarboxamide IUPAC Name: (1S,2S)-2-N-benzyl-1-N-[(4-carbamimidoylphenyl)methyl]cyclopentane-1,2-dicarboxamide Traditional Name: (1S,2S)-N-(4-amidinobenzyl)-N'-benzyl-cyclopentane-1,2-dicarboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)C(=O)NCC2=CC=C(C=C2)C(=N)N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]([C@H](C1)C(=O)NCC2=CC=C(C=C2)C(=N)N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c23-20(24)17-11-9-16(10-12-17)14-26-22(28)19-8-4-7-18(19)21(27)25-13-15-5-2-1-3-6-15/h1-3,5-6,9-12,18-19H,4,7-8,13-14H2,(H3,23,24)(H,25,27)(H,26,28)/t18-,19-/m0/s1