N-(3-aminocarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,8-dimethyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,8-dimethyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,8-dimethyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,8-dimethyl-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,8-dimethyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,8-dimethyl-2-(2-pyridyl)cinchoninamide Formula: C27H26N4O2S MolecularWeight: 470.58594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)N)C

InChI

InChI=1S/C27H26N4O2S/c1-15-11-12-17-19(14-21(30-24(17)16(15)2)20-9-6-7-13-29-20)26(33)31-27-23(25(28)32)18-8-4-3-5-10-22(18)34-27/h6-7,9,11-14H,3-5,8,10H2,1-2H3,(H2,28,32)(H,31,33)