N-[4-(4-cyanopyridin-2-yl)-3-(4-quinolin-2-ylbutylsulfanyl)-1H-pyrazol-5-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-(4-cyanopyridin-2-yl)-3-(4-quinolin-2-ylbutylsulfanyl)-1H-pyrazol-5-yl]naphthalene-2-sulfonamide Openeye Name: N-[4-(4-cyano-2-pyridyl)-3-[4-(2-quinolyl)butylsulfanyl]-1H-pyrazol-5-yl]naphthalene-2-sulfonamide CAS Name: N-[4-(4-cyano-2-pyridinyl)-3-[4-(2-quinolinyl)butylthio]-1H-pyrazol-5-yl]-2-naphthalenesulfonamide IUPAC Name: N-[4-(4-cyanopyridin-2-yl)-3-(4-quinolin-2-ylbutylsulfanyl)-1H-pyrazol-5-yl]naphthalene-2-sulfonamide Traditional Name: N-[4-(4-cyano-2-pyridyl)-3-[4-(2-quinolyl)butylthio]-1H-pyrazol-5-yl]naphthalene-2-sulfonamide Formula: C32H26N6O2S2 MolecularWeight: 590.71784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC3=C(C(=NN3)SCCCCC4=NC5=CC=CC=C5C=C4)C6=NC=CC(=C6)C#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC3=C(C(=NN3)SCCCCC4=NC5=CC=CC=C5C=C4)C6=NC=CC(=C6)C#N

InChI

InChI=1S/C32H26N6O2S2/c33-21-22-16-17-34-29(19-22)30-31(38-42(39,40)27-15-13-23-7-1-2-9-25(23)20-27)36-37-32(30)41-18-6-5-10-26-14-12-24-8-3-4-11-28(24)35-26/h1-4,7-9,11-17,19-20H,5-6,10,18H2,(H2,36,37,38)