N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloranyl-2-oxidanylidene-6-phenyl-3-[(phenylmethyl)amino]pyrazin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloranyl-2-oxidanylidene-6-phenyl-3-[(phenylmethyl)amino]pyrazin-1-yl]ethanamide Openeye Name: 2-[3-(benzylamino)-5-chloro-2-oxo-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl-3-[(phenylmethyl)amino]-1-pyrazinyl]acetamide IUPAC Name: 2-[3-(benzylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(benzylamino)-5-chloro-2-keto-6-phenyl-pyrazin-1-yl]acetamide Formula: C27H25ClN6O2 MolecularWeight: 500.9794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=C(N(C2=O)CC(=O)NCC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=C(N(C2=O)CC(=O)NCC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4)Cl

InChI

InChI=1S/C27H25ClN6O2/c28-24-23(20-9-5-2-6-10-20)34(27(36)26(33-24)32-16-18-7-3-1-4-8-18)17-22(35)31-15-19-11-13-21(14-12-19)25(29)30/h1-14H,15-17H2,(H3,29,30)(H,31,35)(H,32,33)