5,6-dimethyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C15H13N5OS3 MolecularWeight: 375.49162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NNC(=N3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NNC(=N3)C4=CC=CS4)C

InChI

InChI=1S/C15H13N5OS3/c1-7-8(2)24-14-11(7)13(21)16-10(17-14)6-23-15-18-12(19-20-15)9-4-3-5-22-9/h3-5H,6H2,1-2H3,(H,16,17,21)(H,18,19,20)