3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-6-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-6-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-6-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(2-bromo-4-methylphenyl)-6-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide IUPAC Name: 3-amino-N-(2-bromo-4-methylphenyl)-6-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-6-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Formula: C25H22BrN3OS MolecularWeight: 492.43068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC4=C(CCC(C4)C5=CC=CC=C5)N=C3S2)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC4=C(CCC(C4)C5=CC=CC=C5)N=C3S2)N)Br

InChI

InChI=1S/C25H22BrN3OS/c1-14-7-9-21(19(26)11-14)28-24(30)23-22(27)18-13-17-12-16(15-5-3-2-4-6-15)8-10-20(17)29-25(18)31-23/h2-7,9,11,13,16H,8,10,12,27H2,1H3,(H,28,30)