2-[3-(4-methylphenoxy)propylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[3-(4-methylphenoxy)propylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[3-(4-methylphenoxy)propylsulfanyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[3-(4-methylphenoxy)propylthio]-5-(4-methylphenyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[3-(4-methylphenoxy)propylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[3-(4-methylphenoxy)propylthio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C26H26N2O2S2 MolecularWeight: 462.62684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCCOC4=CC=C(C=C4)C)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCCOC4=CC=C(C=C4)C)CC=C

InChI

InChI=1S/C26H26N2O2S2/c1-4-14-28-25(29)23-22(20-10-6-18(2)7-11-20)17-32-24(23)27-26(28)31-16-5-15-30-21-12-8-19(3)9-13-21/h4,6-13,17H,1,5,14-16H2,2-3H3