1-(2-azanyl-3-phenyl-propanoyl)-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide hydrochloride

Systemtic Name: 1-(2-azanyl-3-phenyl-propanoyl)-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide hydrochloride Openeye Name: 1-(2-amino-3-phenyl-propanoyl)-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide hydrochloride CAS Name: 1-(2-amino-1-oxo-3-phenylpropyl)-N-[(4-carbamimidoylphenyl)methyl]-2-pyrrolidinecarboxamide hydrochloride IUPAC Name: 1-(2-amino-3-phenylpropanoyl)-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-1-phenylalanyl-pyrrolidine-2-carboxamide hydrochloride Formula: C22H28ClN5O2 MolecularWeight: 429.94302

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)C(=O)NCC3=CC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)C(=O)NCC3=CC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C22H27N5O2.ClH/c23-18(13-15-5-2-1-3-6-15)22(29)27-12-4-7-19(27)21(28)26-14-16-8-10-17(11-9-16)20(24)25;/h1-3,5-6,8-11,18-19H,4,7,12-14,23H2,(H3,24,25)(H,26,28);1H