3,6-bis(chloranyl)-N-(quinolin-5-ylcarbamothioyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(quinolin-5-ylcarbamothioyl)-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-(5-quinolylcarbamothioyl)benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(5-quinolinylamino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(quinolin-5-ylcarbamothioyl)-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-(5-quinolylthiocarbamoyl)benzothiophene-2-carboxamide Formula: C19H11Cl2N3OS2 MolecularWeight: 432.34614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H11Cl2N3OS2/c20-10-6-7-12-15(9-10)27-17(16(12)21)18(25)24-19(26)23-14-5-1-4-13-11(14)3-2-8-22-13/h1-9H,(H2,23,24,25,26)