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

Systemtic Name: 5-(4-methylphenyl)-2-(2-methylsulfanylethylsulfanyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-(2-methylsulfanylethylsulfanyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-2-[2-(methylthio)ethylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-2-(2-methylsulfanylethylsulfanyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[2-(methylthio)ethylthio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C19H20N2OS3 MolecularWeight: 388.5699

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2OS3/c1-4-9-21-18(22)16-15(14-7-5-13(2)6-8-14)12-25-17(16)20-19(21)24-11-10-23-3/h4-8,12H,1,9-11H2,2-3H3