N1-[(4-carbamimidoylphenyl)methyl]-N2-phenethyl-cyclopentene-1,2-dicarboxamide

Systemtic Name: N1-[(4-carbamimidoylphenyl)methyl]-N2-phenethyl-cyclopentene-1,2-dicarboxamide Openeye Name: N1-[(4-carbamimidoylphenyl)methyl]-N2-phenethyl-cyclopentene-1,2-dicarboxamide CAS Name: N1-[(4-carbamimidoylphenyl)methyl]-N2-phenethylcyclopentene-1,2-dicarboxamide IUPAC Name: 1-N-[(4-carbamimidoylphenyl)methyl]-2-N-phenethylcyclopentene-1,2-dicarboxamide Traditional Name: N-(4-amidinobenzyl)-N'-phenethyl-cyclopentene-1,2-dicarboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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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)NCCC3=CC=CC=C3

Isomeric SMILES

C1CC(=C(C1)C(=O)NCC2=CC=C(C=C2)C(=N)N)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O2/c24-21(25)18-11-9-17(10-12-18)15-27-23(29)20-8-4-7-19(20)22(28)26-14-13-16-5-2-1-3-6-16/h1-3,5-6,9-12H,4,7-8,13-15H2,(H3,24,25)(H,26,28)(H,27,29)