3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutan-2-one

Systemtic Name: 3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutan-2-one Openeye Name: 3-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutan-2-one CAS Name: 3-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]-2-butanone IUPAC Name: 3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutan-2-one Traditional Name: 3-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]butan-2-one Formula: C17H16N2OS2 MolecularWeight: 328.45174

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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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2OS2/c1-10-4-6-13(7-5-10)14-8-21-16-15(14)17(19-9-18-16)22-12(3)11(2)20/h4-9,12H,1-3H3