2-[2,3-bis(oxidanyl)propylsulfanyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2,3-bis(oxidanyl)propylsulfanyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(2,3-dihydroxypropylsulfanyl)-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(2,3-dihydroxypropylthio)-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(2,3-dihydroxypropylsulfanyl)-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(glycerylthio)-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H16N2O3S2 MolecularWeight: 348.43984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCC(CO)O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCC(CO)O)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O3S2/c1-9-12(10-5-3-2-4-6-10)13-14(21)17-16(18-15(13)23-9)22-8-11(20)7-19/h2-6,11,19-20H,7-8H2,1H3,(H,17,18,21)