5-(5-methylthiophen-2-yl)-2-[(phenylmethylsulfanyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(5-methylthiophen-2-yl)-2-[(phenylmethylsulfanyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(benzylsulfanylmethyl)-5-(5-methyl-2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(5-methyl-2-thiophenyl)-2-[(phenylmethylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(benzylsulfanylmethyl)-5-(5-methylthiophen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(benzylthio)methyl]-5-(5-methyl-2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H16N2OS3 MolecularWeight: 384.53814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)CSCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)CSCC4=CC=CC=C4

InChI

InChI=1S/C19H16N2OS3/c1-12-7-8-15(25-12)14-10-24-19-17(14)18(22)20-16(21-19)11-23-9-13-5-3-2-4-6-13/h2-8,10H,9,11H2,1H3,(H,20,21,22)