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

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloranyl-2-methyl-6-oxidanylidene-5-(phenethylamino)pyrazin-1-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-methyl-6-oxo-5-(phenethylamino)pyrazin-1-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-methyl-6-oxo-5-(phenethylamino)-1-pyrazinyl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-methyl-6-oxo-5-(phenethylamino)pyrazin-1-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[5-chloro-2-keto-6-methyl-3-(phenethylamino)pyrazin-1-yl]acetamide Formula: C23H25ClN6O2 MolecularWeight: 452.9366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN6O2/c1-15-20(24)29-22(27-12-11-16-5-3-2-4-6-16)23(32)30(15)14-19(31)28-13-17-7-9-18(10-8-17)21(25)26/h2-10H,11-14H2,1H3,(H3,25,26)(H,27,29)(H,28,31)