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

Systemtic Name: 2-azanyl-N-(4-chlorophenyl)-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(4-chlorophenyl)-1-isobutyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(4-chlorophenyl)-1-(2-methylpropyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(4-chlorophenyl)-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(4-chlorophenyl)-1-isobutyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C21H20ClN5O MolecularWeight: 393.8694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=CC=C(C=C4)Cl)N

Isomeric SMILES

CC(C)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C21H20ClN5O/c1-12(2)11-27-19(23)17(21(28)24-14-9-7-13(22)8-10-14)18-20(27)26-16-6-4-3-5-15(16)25-18/h3-10,12H,11,23H2,1-2H3,(H,24,28)