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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-thienyl)cinchoninamide Formula: C29H21N3OS3 MolecularWeight: 523.69154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)C6=NC7=CC=CC=C7S6

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)C6=NC7=CC=CC=C7S6

InChI

InChI=1S/C29H21N3OS3/c33-27(19-16-22(24-14-7-15-34-24)30-20-10-3-1-8-17(19)20)32-29-26(18-9-2-5-12-23(18)35-29)28-31-21-11-4-6-13-25(21)36-28/h1,3-4,6-8,10-11,13-16H,2,5,9,12H2,(H,32,33)