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

Systemtic Name: 2-[2-(3-aminophenyl)-3-chloranyl-6-oxidanylidene-5-[(phenylmethyl)amino]pyrazin-1-yl]-N-[[4-(azanylmethylideneamino)phenyl]methyl]ethanamide Openeye Name: N-[[4-(aminomethyleneamino)phenyl]methyl]-2-[2-(3-aminophenyl)-5-(benzylamino)-3-chloro-6-oxo-pyrazin-1-yl]acetamide CAS Name: N-[[4-(aminomethylideneamino)phenyl]methyl]-2-[2-(3-aminophenyl)-3-chloro-6-oxo-5-[(phenylmethyl)amino]-1-pyrazinyl]acetamide IUPAC Name: N-[[4-(aminomethylideneamino)phenyl]methyl]-2-[2-(3-aminophenyl)-5-(benzylamino)-3-chloro-6-oxopyrazin-1-yl]acetamide Traditional Name: N-[4-(aminomethyleneamino)benzyl]-2-[2-(3-aminophenyl)-5-(benzylamino)-3-chloro-6-keto-pyrazin-1-yl]acetamide Formula: C27H26ClN7O2 MolecularWeight: 515.99404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=C(N(C2=O)CC(=O)NCC3=CC=C(C=C3)N=CN)C4=CC(=CC=C4)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=C(N(C2=O)CC(=O)NCC3=CC=C(C=C3)N=CN)C4=CC(=CC=C4)N)Cl

InChI

InChI=1S/C27H26ClN7O2/c28-25-24(20-7-4-8-21(30)13-20)35(27(37)26(34-25)32-15-18-5-2-1-3-6-18)16-23(36)31-14-19-9-11-22(12-10-19)33-17-29/h1-13,17H,14-16,30H2,(H2,29,33)(H,31,36)(H,32,34)