2-azanyl-N-hexyl-1-[(E)-(2-methylphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-hexyl-1-[(E)-(2-methylphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-hexyl-1-[(E)-o-tolylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-hexyl-1-[(E)-(2-methylphenyl)methylideneamino]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-hexyl-1-[(E)-(2-methylphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-hexyl-1-[(E)-(2-methylbenzylidene)amino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=CC=C4C)N

Isomeric SMILES

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CC=CC=C4C)N

InChI

InChI=1S/C25H28N6O/c1-3-4-5-10-15-27-25(32)21-22-24(30-20-14-9-8-13-19(20)29-22)31(23(21)26)28-16-18-12-7-6-11-17(18)2/h6-9,11-14,16H,3-5,10,15,26H2,1-2H3,(H,27,32)/b28-16+