2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-allyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-5-(4-methylphenyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-3-allyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C26H24N2O3S2 MolecularWeight: 476.61036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=C(C=CC(=C4)C(=O)C)OC)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=C(C=CC(=C4)C(=O)C)OC)CC=C

InChI

InChI=1S/C26H24N2O3S2/c1-5-12-28-25(30)23-21(18-8-6-16(2)7-9-18)15-32-24(23)27-26(28)33-14-20-13-19(17(3)29)10-11-22(20)31-4/h5-11,13,15H,1,12,14H2,2-4H3