2-(1,3-benzoxazol-2-ylsulfanylmethyl)-5-(5-methylthiophen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-5-(5-methylthiophen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-5-(5-methyl-2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-5-(5-methyl-2-thiophenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-5-(5-methylthiophen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-5-(5-methyl-2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H13N3O2S3 MolecularWeight: 411.52042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C19H13N3O2S3/c1-10-6-7-14(27-10)11-8-25-18-16(11)17(23)21-15(22-18)9-26-19-20-12-4-2-3-5-13(12)24-19/h2-8H,9H2,1H3,(H,21,22,23)