6-methyl-2-(3-phenoxypropylsulfanyl)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-2-(3-phenoxypropylsulfanyl)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-(3-phenoxypropylsulfanyl)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-(3-phenoxypropylthio)-3,5-diphenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-methyl-2-(3-phenoxypropylsulfanyl)-3,5-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-2-(3-phenoxypropylthio)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Formula: C28H24N2O2S2 MolecularWeight: 484.63236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCCCOC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCCCOC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H24N2O2S2/c1-20-24(21-12-5-2-6-13-21)25-26(34-20)29-28(30(27(25)31)22-14-7-3-8-15-22)33-19-11-18-32-23-16-9-4-10-17-23/h2-10,12-17H,11,18-19H2,1H3