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

Systemtic Name: 2-azanyl-1-(3,5-dimethylphenyl)-N-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: N-allyl-2-amino-1-(3,5-dimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3,5-dimethylphenyl)-N-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3,5-dimethylphenyl)-N-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: N-allyl-2-amino-1-(3,5-dimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O/c1-4-9-24-22(28)18-19-21(26-17-8-6-5-7-16(17)25-19)27(20(18)23)15-11-13(2)10-14(3)12-15/h4-8,10-12H,1,9,23H2,2-3H3,(H,24,28)