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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H13N3OS3 MolecularWeight: 359.48892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C16H13N3OS3/c1-8-9(2)22-15-13(8)14(20)18-12(19-15)7-21-16-17-10-5-3-4-6-11(10)23-16/h3-6H,7H2,1-2H3,(H,18,19,20)