2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(6-ethoxy-3-methyl-2-quinolyl)sulfanyl]-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(6-ethoxy-3-methyl-2-quinolinyl)thio]-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-ethoxy-3-methylquinolin-2-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(6-ethoxy-3-methyl-2-quinolyl)thio]-N-(4-piperidinosulfonylphenyl)acetamide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C25H29N3O4S2/c1-3-32-21-9-12-23-19(16-21)15-18(2)25(27-23)33-17-24(29)26-20-7-10-22(11-8-20)34(30,31)28-13-5-4-6-14-28/h7-12,15-16H,3-6,13-14,17H2,1-2H3,(H,26,29)