2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-ethanamide hydrochloride

Systemtic Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-ethanamide hydrochloride Openeye Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-acetamide hydrochloride CAS Name: 2-[3-(3-aminophenyl)-1-pyrazolyl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxyacetamide hydrochloride IUPAC Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxyacetamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-2-[3-(3-aminophenyl)pyrazol-1-yl]-2-ethoxy-acetamide hydrochloride Formula: C21H25ClN6O2 MolecularWeight: 428.9152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC(=N2)C3=CC(=CC=C3)N.Cl

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC(=N2)C3=CC(=CC=C3)N.Cl

InChI

InChI=1S/C21H24N6O2.ClH/c1-2-29-21(20(28)25-13-14-6-8-15(9-7-14)19(23)24)27-11-10-18(26-27)16-4-3-5-17(22)12-16;/h3-12,21H,2,13,22H2,1H3,(H3,23,24)(H,25,28);1H