N-[(4-carbamimidoylphenyl)methyl]-1-(4-phenylbutanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-1-(4-phenylbutanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-1-(4-phenylbutanoyl)pyrrolidine-2-carboxamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-1-(1-oxo-4-phenylbutyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-1-(4-phenylbutanoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-amidinobenzyl)-1-(4-phenylbutanoyl)pyrrolidine-2-carboxamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CC(N(C1)C(=O)CCCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H28N4O2/c24-22(25)19-13-11-18(12-14-19)16-26-23(29)20-9-5-15-27(20)21(28)10-4-8-17-6-2-1-3-7-17/h1-3,6-7,11-14,20H,4-5,8-10,15-16H2,(H3,24,25)(H,26,29)