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

Systemtic Name: 3,6-bis(chloranyl)-N-[(2-ethylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(2-ethylphenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(2-ethylanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(2-ethylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(2-ethylphenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C18H14Cl2N2OS2 MolecularWeight: 409.35256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H14Cl2N2OS2/c1-2-10-5-3-4-6-13(10)21-18(24)22-17(23)16-15(20)12-8-7-11(19)9-14(12)25-16/h3-9H,2H2,1H3,(H2,21,22,23,24)