N-[2,2-dimethyl-3-(4-methylsulfanylpyrimidin-5-yl)-1,3-dihydroinden-5-yl]benzenesulfonamide

Systemtic Name: N-[2,2-dimethyl-3-(4-methylsulfanylpyrimidin-5-yl)-1,3-dihydroinden-5-yl]benzenesulfonamide Openeye Name: N-[2,2-dimethyl-3-(4-methylsulfanylpyrimidin-5-yl)indan-5-yl]benzenesulfonamide CAS Name: N-[2,2-dimethyl-3-[4-(methylthio)-5-pyrimidinyl]-1,3-dihydroinden-5-yl]benzenesulfonamide IUPAC Name: N-[2,2-dimethyl-3-(4-methylsulfanylpyrimidin-5-yl)-1,3-dihydroinden-5-yl]benzenesulfonamide Traditional Name: N-[2,2-dimethyl-3-[4-(methylthio)pyrimidin-5-yl]indan-5-yl]benzenesulfonamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C1C3=CN=CN=C3SC)C=C(C=C2)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C1C3=CN=CN=C3SC)C=C(C=C2)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H23N3O2S2/c1-22(2)12-15-9-10-16(25-29(26,27)17-7-5-4-6-8-17)11-18(15)20(22)19-13-23-14-24-21(19)28-3/h4-11,13-14,20,25H,12H2,1-3H3