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

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H12ClN3OS3 MolecularWeight: 393.93398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC4=C(S3)C=CC(=C4)Cl)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC4=C(S3)C=CC(=C4)Cl)C

InChI

InChI=1S/C16H12ClN3OS3/c1-7-8(2)23-15-13(7)14(21)19-12(20-15)6-22-16-18-10-5-9(17)3-4-11(10)24-16/h3-5H,6H2,1-2H3,(H,19,20,21)