4-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-benzimidazol-5-yl]-cyclopentyl-amino]-4-oxidanylidene-butanoic acid hydrochloride

Systemtic Name: 4-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-benzimidazol-5-yl]-cyclopentyl-amino]-4-oxidanylidene-butanoic acid hydrochloride Openeye Name: 4-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-benzimidazol-5-yl]-cyclopentyl-amino]-4-oxo-butanoic acid hydrochloride CAS Name: 4-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-5-benzimidazolyl]-cyclopentylamino]-4-oxobutanoic acid hydrochloride IUPAC Name: 4-[[2-[(4-carbamimidoylphenyl)methyl]-1-methylbenzimidazol-5-yl]-cyclopentylamino]-4-oxobutanoic acid hydrochloride Traditional Name: 4-[[2-(4-amidinobenzyl)-1-methyl-benzimidazol-5-yl]-cyclopentyl-amino]-4-keto-butyric acid hydrochloride Formula: C25H30ClN5O3 MolecularWeight: 483.9904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)N(C3CCCC3)C(=O)CCC(=O)O)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)N(C3CCCC3)C(=O)CCC(=O)O)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C25H29N5O3.ClH/c1-29-21-11-10-19(30(18-4-2-3-5-18)23(31)12-13-24(32)33)15-20(21)28-22(29)14-16-6-8-17(9-7-16)25(26)27;/h6-11,15,18H,2-5,12-14H2,1H3,(H3,26,27)(H,32,33);1H