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

Systemtic Name: 2-azanyl-1-(3-bromophenyl)-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3-bromophenyl)-N-(2-thienylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3-bromophenyl)-N-(thiophen-2-ylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3-bromophenyl)-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3-bromophenyl)-N-(2-thenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H16BrN5OS MolecularWeight: 478.36434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3C(=C(N(C3=N2)C4=CC(=CC=C4)Br)N)C(=O)NCC5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)N=C3C(=C(N(C3=N2)C4=CC(=CC=C4)Br)N)C(=O)NCC5=CC=CS5

InChI

InChI=1S/C22H16BrN5OS/c23-13-5-3-6-14(11-13)28-20(24)18(22(29)25-12-15-7-4-10-30-15)19-21(28)27-17-9-2-1-8-16(17)26-19/h1-11H,12,24H2,(H,25,29)