6-methyl-5-(4-methylphenyl)-2-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(4-methylphenyl)-2-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-5-(p-tolyl)-2-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-5-(4-methylphenyl)-2-[(1,3,4-thiadiazol-2-ylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-5-(4-methylphenyl)-2-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-5-(p-tolyl)-2-[(1,3,4-thiadiazol-2-ylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H14N4OS3 MolecularWeight: 386.51426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NN=CS4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NN=CS4)C

InChI

InChI=1S/C17H14N4OS3/c1-9-3-5-11(6-4-9)13-10(2)25-16-14(13)15(22)19-12(20-16)7-23-17-21-18-8-24-17/h3-6,8H,7H2,1-2H3,(H,19,20,22)