7-methyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 7-methyl-2-[2-(2-methylindolin-1-yl)-2-oxo-ethyl]sulfanyl-3-octyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 7-methyl-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 7-methyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-3-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(2-methylindolin-1-yl)ethyl]thio]-7-methyl-3-octyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C30H39N3O2S2 MolecularWeight: 537.77956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C2=C(N=C1SCC(=O)N3C(CC4=CC=CC=C43)C)SC5=C2CCC(C5)C

Isomeric SMILES

CCCCCCCCN1C(=O)C2=C(N=C1SCC(=O)N3C(CC4=CC=CC=C43)C)SC5=C2CCC(C5)C

InChI

InChI=1S/C30H39N3O2S2/c1-4-5-6-7-8-11-16-32-29(35)27-23-15-14-20(2)17-25(23)37-28(27)31-30(32)36-19-26(34)33-21(3)18-22-12-9-10-13-24(22)33/h9-10,12-13,20-21H,4-8,11,14-19H2,1-3H3