3-(3-fluorophenyl)sulfanyl-6,6-dimethyl-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one

Systemtic Name: 3-(3-fluorophenyl)sulfanyl-6,6-dimethyl-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 3-(3-fluorophenyl)sulfanyl-6,6-dimethyl-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one CAS Name: 3-[(3-fluorophenyl)thio]-6,6-dimethyl-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 3-(3-fluorophenyl)sulfanyl-6,6-dimethyl-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 3-[(3-fluorophenyl)thio]-6,6-dimethyl-1-(1H-pyrazol-5-yl)-5,7-dihydroisobenzothiophen-4-one Formula: C19H17FN2OS2 MolecularWeight: 372.479483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SC3=CC=CC(=C3)F)C4=CC=NN4)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SC3=CC=CC(=C3)F)C4=CC=NN4)C

InChI

InChI=1S/C19H17FN2OS2/c1-19(2)9-13-16(15(23)10-19)18(24-12-5-3-4-11(20)8-12)25-17(13)14-6-7-21-22-14/h3-8H,9-10H2,1-2H3,(H,21,22)