N-[(4-chlorophenyl)carbamothioyl]-3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxamide

Systemtic Name: N-[(4-chlorophenyl)carbamothioyl]-3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxamide Openeye Name: N-[(4-chlorophenyl)carbamothioyl]-3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxamide CAS Name: N-[(4-chloroanilino)-sulfanylidenemethyl]-3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxamide IUPAC Name: N-[(4-chlorophenyl)carbamothioyl]-3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxamide Traditional Name: N-[(4-chlorophenyl)thiocarbamoyl]-3-mesyl-6,7-dihydroisobenzothiophene-1-carboxamide Formula: C17H15ClN2O3S3 MolecularWeight: 426.9606

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C2C=CCCC2=C(S1)C(=O)NC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C2C=CCCC2=C(S1)C(=O)NC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN2O3S3/c1-26(22,23)16-13-5-3-2-4-12(13)14(25-16)15(21)20-17(24)19-11-8-6-10(18)7-9-11/h3,5-9H,2,4H2,1H3,(H2,19,20,21,24)