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

Systemtic Name: N-[[4-(azanylmethylideneamino)phenyl]methyl]-2-[3-chloranyl-2-(2-methylphenyl)-6-oxidanylidene-5-(phenethylamino)pyrazin-1-yl]ethanamide Openeye Name: N-[[4-(aminomethyleneamino)phenyl]methyl]-2-[3-chloro-2-(o-tolyl)-6-oxo-5-(phenethylamino)pyrazin-1-yl]acetamide CAS Name: N-[[4-(aminomethylideneamino)phenyl]methyl]-2-[3-chloro-2-(2-methylphenyl)-6-oxo-5-(phenethylamino)-1-pyrazinyl]acetamide IUPAC Name: N-[[4-(aminomethylideneamino)phenyl]methyl]-2-[3-chloro-2-(2-methylphenyl)-6-oxo-5-(phenethylamino)pyrazin-1-yl]acetamide Traditional Name: N-[4-(aminomethyleneamino)benzyl]-2-[5-chloro-2-keto-6-(o-tolyl)-3-(phenethylamino)pyrazin-1-yl]acetamide Formula: C29H29ClN6O2 MolecularWeight: 529.03256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(N=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)N=CN)NCCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1C2=C(N=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)N=CN)NCCC4=CC=CC=C4)Cl

InChI

InChI=1S/C29H29ClN6O2/c1-20-7-5-6-10-24(20)26-27(30)35-28(32-16-15-21-8-3-2-4-9-21)29(38)36(26)18-25(37)33-17-22-11-13-23(14-12-22)34-19-31/h2-14,19H,15-18H2,1H3,(H2,31,34)(H,32,35)(H,33,37)