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

Systemtic Name: 6-methyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-[3-(4-methylphenoxy)propylthio]-3,5-diphenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-methyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3,5-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-2-[3-(4-methylphenoxy)propylthio]-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Formula: C29H26N2O2S2 MolecularWeight: 498.65894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCSC2=NC3=C(C(=C(S3)C)C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)OCCCSC2=NC3=C(C(=C(S3)C)C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O2S2/c1-20-14-16-24(17-15-20)33-18-9-19-34-29-30-27-26(28(32)31(29)23-12-7-4-8-13-23)25(21(2)35-27)22-10-5-3-6-11-22/h3-8,10-17H,9,18-19H2,1-2H3