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

Systemtic Name: 2-[3-(butylamino)-5-chloranyl-2-oxidanylidene-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide Openeye Name: 2-[3-(butylamino)-5-chloro-2-oxo-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[3-(butylamino)-5-chloro-2-oxo-6-phenyl-1-pyrazinyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[3-(butylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(butylamino)-5-chloro-2-keto-6-phenyl-pyrazin-1-yl]acetamide Formula: C24H27ClN6O2 MolecularWeight: 466.96318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=C(N(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)N)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCNC1=NC(=C(N(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)N)C3=CC=CC=C3)Cl

InChI

InChI=1S/C24H27ClN6O2/c1-2-3-13-28-23-24(33)31(20(21(25)30-23)17-7-5-4-6-8-17)15-19(32)29-14-16-9-11-18(12-10-16)22(26)27/h4-12H,2-3,13-15H2,1H3,(H3,26,27)(H,28,30)(H,29,32)