3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(2-bromo-4-methylphenyl)-4,6-diphenyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(2-bromo-4-methylphenyl)-4,6-diphenylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C27H20BrN3OS MolecularWeight: 514.4362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5)N)Br

InChI

InChI=1S/C27H20BrN3OS/c1-16-12-13-21(20(28)14-16)30-26(32)25-24(29)23-19(17-8-4-2-5-9-17)15-22(31-27(23)33-25)18-10-6-3-7-11-18/h2-15H,29H2,1H3,(H,30,32)