4-bromanyl-N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide Openeye Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-4-bromo-benzamide CAS Name: 4-bromo-N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide IUPAC Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-4-bromobenzamide Traditional Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-4-bromo-benzamide Formula: C22H18BrN3OS MolecularWeight: 452.36682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)NC(=O)C3=CC=C(C=C3)Br)C#N)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)NC(=O)C3=CC=C(C=C3)Br)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C22H18BrN3OS/c23-17-8-6-16(7-9-17)21(27)25-22-19(12-24)18-10-11-26(14-20(18)28-22)13-15-4-2-1-3-5-15/h1-9H,10-11,13-14H2,(H,25,27)