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

Systemtic Name: 2-azanyl-1-[(E)-(3-methylphenyl)methylideneamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(E)-m-tolylmethyleneamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(E)-(3-methylphenyl)methylideneamino]-N-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(E)-(3-methylphenyl)methylideneamino]-N-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[(E)-(3-methylbenzylidene)amino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H24N6O MolecularWeight: 448.51906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N

Isomeric SMILES

CC1=CC=CC(=C1)/C=N/N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N

InChI

InChI=1S/C27H24N6O/c1-18-8-7-11-20(16-18)17-30-33-25(28)23(27(34)29-15-14-19-9-3-2-4-10-19)24-26(33)32-22-13-6-5-12-21(22)31-24/h2-13,16-17H,14-15,28H2,1H3,(H,29,34)/b30-17+