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

Systemtic Name: 3,6-bis(chloranyl)-N-[(4-dimethylaminophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(4-dimethylaminophenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(4-dimethylaminophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(4-dimethylaminophenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C18H15Cl2N3OS2 MolecularWeight: 424.3672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15Cl2N3OS2/c1-23(2)12-6-4-11(5-7-12)21-18(25)22-17(24)16-15(20)13-8-3-10(19)9-14(13)26-16/h3-9H,1-2H3,(H2,21,22,24,25)