3-chloranyl-N-[ethyl(phenyl)carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[ethyl(phenyl)carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[ethyl(phenyl)carbamothioyl]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(N-ethylanilino)-sulfanylidenemethyl]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[ethyl(phenyl)carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[ethyl(phenyl)thiocarbamoyl]-6-methoxy-benzothiophene-2-carboxamide Formula: C19H17ClN2O2S2 MolecularWeight: 404.93348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN2O2S2/c1-3-22(12-7-5-4-6-8-12)19(25)21-18(23)17-16(20)14-10-9-13(24-2)11-15(14)26-17/h4-11H,3H2,1-2H3,(H,21,23,25)