2-azanyl-1-(3,5-dimethylphenyl)-N-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(3,5-dimethylphenyl)-N-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3,5-dimethylphenyl)-N-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3,5-dimethylphenyl)-N-phenyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3,5-dimethylphenyl)-N-phenylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3,5-dimethylphenyl)-N-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=CC=C5)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=CC=C5)N)C

InChI

InChI=1S/C25H21N5O/c1-15-12-16(2)14-18(13-15)30-23(26)21(25(31)27-17-8-4-3-5-9-17)22-24(30)29-20-11-7-6-10-19(20)28-22/h3-14H,26H2,1-2H3,(H,27,31)