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

Systemtic Name: 2-[3-(aminomethyl)-5-chloranyl-2-oxidanylidene-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide Openeye Name: 2-[3-(aminomethyl)-5-chloro-2-oxo-6-phenyl-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[3-(aminomethyl)-5-chloro-2-oxo-6-phenyl-1-pyrazinyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[3-(aminomethyl)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(aminomethyl)-5-chloro-2-keto-6-phenyl-pyrazin-1-yl]acetamide Formula: C21H21ClN6O2 MolecularWeight: 424.88344

Click to see the large picture

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)CN)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN6O2/c22-19-18(14-4-2-1-3-5-14)28(21(30)16(10-23)27-19)12-17(29)26-11-13-6-8-15(9-7-13)20(24)25/h1-9H,10-12,23H2,(H3,24,25)(H,26,29)