3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-4-oxidanyl-pent-3-en-2-one

Systemtic Name: 3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-4-oxidanyl-pent-3-en-2-one Openeye Name: 4-hydroxy-3-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-pent-3-en-2-one CAS Name: 4-hydroxy-3-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]-3-penten-2-one IUPAC Name: 4-hydroxy-3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpent-3-en-2-one Traditional Name: 4-hydroxy-3-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]pent-3-en-2-one Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC(=C(C)O)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC(=C(C)O)C(=O)C

InChI

InChI=1S/C18H16N2O2S2/c1-10-4-6-13(7-5-10)14-8-23-17-15(14)18(20-9-19-17)24-16(11(2)21)12(3)22/h4-9,21H,1-3H3