2-azanyl-N-(3,4-dimethylphenyl)-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(3,4-dimethylphenyl)-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 1-allyl-2-amino-N-(3,4-dimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(3,4-dimethylphenyl)-1-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(3,4-dimethylphenyl)-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 1-allyl-2-amino-N-(3,4-dimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC=C)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC=C)N)C

InChI

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