(2S)-N-[(4-carbamimidoylphenyl)methyl]-1-(3-methylpentanoyl)pyrrolidine-2-carboxamide hydrochloride

Systemtic Name: (2S)-N-[(4-carbamimidoylphenyl)methyl]-1-(3-methylpentanoyl)pyrrolidine-2-carboxamide hydrochloride Openeye Name: (2S)-N-[(4-carbamimidoylphenyl)methyl]-1-(3-methylpentanoyl)pyrrolidine-2-carboxamide hydrochloride CAS Name: (2S)-N-[(4-carbamimidoylphenyl)methyl]-1-(3-methyl-1-oxopentyl)-2-pyrrolidinecarboxamide hydrochloride IUPAC Name: (2S)-N-[(4-carbamimidoylphenyl)methyl]-1-(3-methylpentanoyl)pyrrolidine-2-carboxamide hydrochloride Traditional Name: (2S)-N-(4-amidinobenzyl)-1-(3-methylpentanoyl)pyrrolidine-2-carboxamide hydrochloride Formula: C19H29ClN4O2 MolecularWeight: 380.91216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)N1CCCC1C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

CCC(C)CC(=O)N1CCC[C@H]1C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C19H28N4O2.ClH/c1-3-13(2)11-17(24)23-10-4-5-16(23)19(25)22-12-14-6-8-15(9-7-14)18(20)21;/h6-9,13,16H,3-5,10-12H2,1-2H3,(H3,20,21)(H,22,25);1H/t13?,16-;/m0./s1