N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxidanylidene-3-(phenethylamino)pyrazin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxidanylidene-3-(phenethylamino)pyrazin-1-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxo-3-(phenethylamino)pyrazin-1-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxo-3-(phenethylamino)-1-pyrazinyl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxo-3-(phenethylamino)pyrazin-1-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[2-keto-6-methyl-3-(phenethylamino)pyrazin-1-yl]acetamide Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)NCC2=CC=C(C=C2)C(=N)N)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)NCC2=CC=C(C=C2)C(=N)N)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H26N6O2/c1-16-13-28-22(26-12-11-17-5-3-2-4-6-17)23(31)29(16)15-20(30)27-14-18-7-9-19(10-8-18)21(24)25/h2-10,13H,11-12,14-15H2,1H3,(H3,24,25)(H,26,28)(H,27,30)