2-azanyl-1-(4-methylphenyl)-N-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(4-methylphenyl)-N-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-isobutyl-1-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-methylphenyl)-N-(2-methylpropyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-methylphenyl)-N-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-isobutyl-1-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O/c1-13(2)12-24-22(28)18-19-21(26-17-7-5-4-6-16(17)25-19)27(20(18)23)15-10-8-14(3)9-11-15/h4-11,13H,12,23H2,1-3H3,(H,24,28)