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

Systemtic Name: 5-(4-methylphenyl)-2-(3-oxidanylpropylsulfanyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-(3-hydroxypropylsulfanyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(3-hydroxypropylthio)-5-(4-methylphenyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(3-hydroxypropylsulfanyl)-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-(3-hydroxypropylthio)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O2S2/c1-3-9-21-18(23)16-15(14-7-5-13(2)6-8-14)12-25-17(16)20-19(21)24-11-4-10-22/h3,5-8,12,22H,1,4,9-11H2,2H3