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

Systemtic Name: 3,6-bis(chloranyl)-N-[(4-ethanoylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-acetylphenyl)carbamothioyl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[(4-acetylanilino)-sulfanylidenemethyl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-acetylphenyl)carbamothioyl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-acetylphenyl)thiocarbamoyl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C18H12Cl2N2O2S2 MolecularWeight: 423.33608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12Cl2N2O2S2/c1-9(23)10-2-5-12(6-3-10)21-18(25)22-17(24)16-15(20)13-7-4-11(19)8-14(13)26-16/h2-8H,1H3,(H2,21,22,24,25)