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

Systemtic Name: 2-[3-(2-azanylethylamino)-5-chloranyl-2-oxidanylidene-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide Openeye Name: 2-[3-(2-aminoethylamino)-5-chloro-2-oxo-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[3-(2-aminoethylamino)-5-chloro-2-oxo-6-phenyl-1-pyrazinyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[3-(2-aminoethylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(2-aminoethylamino)-5-chloro-2-keto-6-phenyl-pyrazin-1-yl]acetamide Formula: C22H24ClN7O2 MolecularWeight: 453.92466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NCCN)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NCCN)Cl

InChI

InChI=1S/C22H24ClN7O2/c23-19-18(15-4-2-1-3-5-15)30(22(32)21(29-19)27-11-10-24)13-17(31)28-12-14-6-8-16(9-7-14)20(25)26/h1-9H,10-13,24H2,(H3,25,26)(H,27,29)(H,28,31)