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

Systemtic Name: 2-azanyl-1-[(E)-(3-methylphenyl)methylideneamino]-N-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: N-allyl-2-amino-1-[(E)-m-tolylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(E)-(3-methylphenyl)methylideneamino]-N-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(E)-(3-methylphenyl)methylideneamino]-N-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: N-allyl-2-amino-1-[(E)-(3-methylbenzylidene)amino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H20N6O MolecularWeight: 384.4338

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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)NCC=C)N

Isomeric SMILES

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

InChI

InChI=1S/C22H20N6O/c1-3-11-24-22(29)18-19-21(27-17-10-5-4-9-16(17)26-19)28(20(18)23)25-13-15-8-6-7-14(2)12-15/h3-10,12-13H,1,11,23H2,2H3,(H,24,29)/b25-13+