4-methyl-N-(2-pyrimidin-2-ylsulfanyl-1,2-dihydroacenaphthylen-1-yl)benzenesulfonamide

Systemtic Name: 4-methyl-N-(2-pyrimidin-2-ylsulfanyl-1,2-dihydroacenaphthylen-1-yl)benzenesulfonamide Openeye Name: 4-methyl-N-(2-pyrimidin-2-ylsulfanyl-1,2-dihydroacenaphthylen-1-yl)benzenesulfonamide CAS Name: 4-methyl-N-[2-(2-pyrimidinylthio)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-(2-pyrimidin-2-ylsulfanyl-1,2-dihydroacenaphthylen-1-yl)benzenesulfonamide Traditional Name: 4-methyl-N-[2-(2-pyrimidylthio)acenaphthen-1-yl]benzenesulfonamide Formula: C23H19N3O2S2 MolecularWeight: 433.54586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NC=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NC=CC=N5

InChI

InChI=1S/C23H19N3O2S2/c1-15-9-11-17(12-10-15)30(27,28)26-21-18-7-2-5-16-6-3-8-19(20(16)18)22(21)29-23-24-13-4-14-25-23/h2-14,21-22,26H,1H3