N-[3-[3-(3-phenoxyphenyl)propylsulfanyl]-4-pyridin-2-yl-1H-pyrazol-5-yl]naphthalene-1-sulfonamide

Systemtic Name: N-[3-[3-(3-phenoxyphenyl)propylsulfanyl]-4-pyridin-2-yl-1H-pyrazol-5-yl]naphthalene-1-sulfonamide Openeye Name: N-[3-[3-(3-phenoxyphenyl)propylsulfanyl]-4-(2-pyridyl)-1H-pyrazol-5-yl]naphthalene-1-sulfonamide CAS Name: N-[3-[3-(3-phenoxyphenyl)propylthio]-4-(2-pyridinyl)-1H-pyrazol-5-yl]-1-naphthalenesulfonamide IUPAC Name: N-[3-[3-(3-phenoxyphenyl)propylsulfanyl]-4-pyridin-2-yl-1H-pyrazol-5-yl]naphthalene-1-sulfonamide Traditional Name: N-[3-[3-(3-phenoxyphenyl)propylthio]-4-(2-pyridyl)-1H-pyrazol-5-yl]naphthalene-1-sulfonamide Formula: C33H28N4O3S2 MolecularWeight: 592.73042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CCCSC3=NNC(=C3C4=CC=CC=N4)NS(=O)(=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CCCSC3=NNC(=C3C4=CC=CC=N4)NS(=O)(=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C33H28N4O3S2/c38-42(39,30-20-9-14-25-13-4-5-18-28(25)30)37-32-31(29-19-6-7-21-34-29)33(36-35-32)41-22-10-12-24-11-8-17-27(23-24)40-26-15-2-1-3-16-26/h1-9,11,13-21,23H,10,12,22H2,(H2,35,36,37)