3,6-bis(chloranyl)-N-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(2-keto-1,3-dihydrobenzimidazol-5-yl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H10Cl2N4O2S2 MolecularWeight: 437.3229

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=S)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)NC(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1NC(=S)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)NC(=O)N2

InChI

InChI=1S/C17H10Cl2N4O2S2/c18-7-1-3-9-12(5-7)27-14(13(9)19)15(24)23-17(26)20-8-2-4-10-11(6-8)22-16(25)21-10/h1-6H,(H2,21,22,25)(H2,20,23,24,26)