N-(1,3-benzodioxol-5-ylmethyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-quinolin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-quinolin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-[(4-methyl-1-piperidyl)sulfonyl]-2-oxo-1-quinolyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-[(4-methyl-1-piperidinyl)sulfonyl]-2-oxo-1-quinolinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-2-oxoquinolin-1-yl]acetamide Traditional Name: 2-[2-keto-6-(4-methylpiperidino)sulfonyl-1-quinolyl]-N-piperonyl-acetamide Formula: C25H27N3O6S MolecularWeight: 497.56338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C=C3)CC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C=C3)CC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H27N3O6S/c1-17-8-10-27(11-9-17)35(31,32)20-4-5-21-19(13-20)3-7-25(30)28(21)15-24(29)26-14-18-2-6-22-23(12-18)34-16-33-22/h2-7,12-13,17H,8-11,14-16H2,1H3,(H,26,29)