N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-phenyl-cinchoninamide Formula: C31H23N3OS2 MolecularWeight: 517.66382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)C6=NC7=CC=CC=C7S6

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)C6=NC7=CC=CC=C7S6

InChI

InChI=1S/C31H23N3OS2/c35-29(22-18-25(19-10-2-1-3-11-19)32-23-14-6-4-12-20(22)23)34-31-28(21-13-5-8-16-26(21)36-31)30-33-24-15-7-9-17-27(24)37-30/h1-4,6-7,9-12,14-15,17-18H,5,8,13,16H2,(H,34,35)