3,6-bis(chloranyl)-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(3-chloro-4-methyl-phenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(3-chloro-4-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H11Cl3N2OS2 MolecularWeight: 429.77104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C17H11Cl3N2OS2/c1-8-2-4-10(7-12(8)19)21-17(24)22-16(23)15-14(20)11-5-3-9(18)6-13(11)25-15/h2-7H,1H3,(H2,21,22,23,24)