2-(1,3-benzoxazol-2-ylmethylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1,3-benzoxazol-2-ylmethylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1,3-benzoxazol-2-ylmethylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1,3-benzoxazol-2-ylmethylthio)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1,3-benzoxazol-2-ylmethylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1,3-benzoxazol-2-ylmethylthio)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSCC3=NC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSCC3=NC4=CC=CC=C4O3)C

InChI

InChI=1S/C17H15N3O2S2/c1-9-10(2)24-17-15(9)16(21)19-13(20-17)7-23-8-14-18-11-5-3-4-6-12(11)22-14/h3-6H,7-8H2,1-2H3,(H,19,20,21)