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

Systemtic Name: 2-azanyl-1-(3,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3,4-dimethylphenyl)-N-(2-thienylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3,4-dimethylphenyl)-N-(2-thenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C24H21N5OS MolecularWeight: 427.52144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=CS5)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=CS5)N)C

InChI

InChI=1S/C24H21N5OS/c1-14-9-10-16(12-15(14)2)29-22(25)20(24(30)26-13-17-6-5-11-31-17)21-23(29)28-19-8-4-3-7-18(19)27-21/h3-12H,13,25H2,1-2H3,(H,26,30)