S-(4,6-dimethylpyrimidin-2-yl) 3-chloranyl-1-benzothiophene-2-carbothioate

Systemtic Name: S-(4,6-dimethylpyrimidin-2-yl) 3-chloranyl-1-benzothiophene-2-carbothioate Openeye Name: S-(4,6-dimethylpyrimidin-2-yl) 3-chlorobenzothiophene-2-carbothioate CAS Name: 3-chloro-1-benzothiophene-2-carbothioic acid S-(4,6-dimethyl-2-pyrimidinyl) ester IUPAC Name: S-(4,6-dimethylpyrimidin-2-yl) 3-chloro-1-benzothiophene-2-carbothioate Traditional Name: 3-chlorobenzothiophene-2-carbothioic acid S-(4,6-dimethylpyrimidin-2-yl) ester Formula: C15H11ClN2OS2 MolecularWeight: 334.84364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

InChI

InChI=1S/C15H11ClN2OS2/c1-8-7-9(2)18-15(17-8)21-14(19)13-12(16)10-5-3-4-6-11(10)20-13/h3-7H,1-2H3