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

Systemtic Name: 6-ethanoyl-5-methyl-2-(phenylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-acetyl-2-benzylsulfanyl-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-acetyl-5-methyl-2-(phenylmethylthio)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-acetyl-2-benzylsulfanyl-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-acetyl-2-(benzylthio)-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H14N2O2S2 MolecularWeight: 330.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)SCC3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)SCC3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C16H14N2O2S2/c1-9-12-14(20)17-16(18-15(12)22-13(9)10(2)19)21-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,17,18,20)