6,6-dimethyl-3-(phenylmethylsulfanyl)-1-pyridin-2-yl-5,7-dihydroindol-4-one

Systemtic Name: 6,6-dimethyl-3-(phenylmethylsulfanyl)-1-pyridin-2-yl-5,7-dihydroindol-4-one Openeye Name: 3-benzylsulfanyl-6,6-dimethyl-1-(2-pyridyl)-5,7-dihydroindol-4-one CAS Name: 6,6-dimethyl-3-(phenylmethylthio)-1-(2-pyridinyl)-5,7-dihydroindol-4-one IUPAC Name: 3-benzylsulfanyl-6,6-dimethyl-1-pyridin-2-yl-5,7-dihydroindol-4-one Traditional Name: 3-(benzylthio)-6,6-dimethyl-1-(2-pyridyl)-5,7-dihydroindol-4-one Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=CN2C3=CC=CC=N3)SCC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=CN2C3=CC=CC=N3)SCC4=CC=CC=C4)C

InChI

InChI=1S/C22H22N2OS/c1-22(2)12-17-21(18(25)13-22)19(26-15-16-8-4-3-5-9-16)14-24(17)20-10-6-7-11-23-20/h3-11,14H,12-13,15H2,1-2H3