2-[3-(3-aminophenyl)-4-chloranyl-6-cyclopentylimino-1-oxidanyl-pyridin-2-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide

Systemtic Name: 2-[3-(3-aminophenyl)-4-chloranyl-6-cyclopentylimino-1-oxidanyl-pyridin-2-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide Openeye Name: 2-[3-(3-aminophenyl)-4-chloro-6-cyclopentylimino-1-hydroxy-2-pyridyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[3-(3-aminophenyl)-4-chloro-6-cyclopentylimino-1-hydroxy-2-pyridinyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[3-(3-aminophenyl)-4-chloro-6-cyclopentylimino-1-hydroxypyridin-2-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(3-aminophenyl)-4-chloro-6-cyclopentylimino-1-hydroxy-2-pyridyl]acetamide Formula: C26H29ClN6O2 MolecularWeight: 493.00046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N=C2C=C(C(=C(N2O)CC(=O)NCC3=CC=C(C=C3)C(=N)N)C4=CC(=CC=C4)N)Cl

Isomeric SMILES

C1CCC(C1)N=C2C=C(C(=C(N2O)CC(=O)NCC3=CC=C(C=C3)C(=N)N)C4=CC(=CC=C4)N)Cl

InChI

InChI=1S/C26H29ClN6O2/c27-21-13-23(32-20-6-1-2-7-20)33(35)22(25(21)18-4-3-5-19(28)12-18)14-24(34)31-15-16-8-10-17(11-9-16)26(29)30/h3-5,8-13,20,35H,1-2,6-7,14-15,28H2,(H3,29,30)(H,31,34)