3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-5,8-dimethyl-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-5,8-dimethyl-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-5,8-dimethyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(2-bromo-4-methylphenyl)-5,8-dimethyl-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-(2-bromo-4-methylphenyl)-5,8-dimethylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-5,8-dimethyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C21H18BrN3OS MolecularWeight: 440.35612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC4=C(C=CC(=C4N=C3S2)C)C)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC4=C(C=CC(=C4N=C3S2)C)C)N)Br

InChI

InChI=1S/C21H18BrN3OS/c1-10-4-7-16(15(22)8-10)24-20(26)19-17(23)14-9-13-11(2)5-6-12(3)18(13)25-21(14)27-19/h4-9H,23H2,1-3H3,(H,24,26)