3-chloranyl-N-[(phenylmethyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(phenylmethyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(benzylcarbamothioyl)-3-chloro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(benzylcarbamothioyl)-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-(benzylthiocarbamoyl)-3-chloro-benzothiophene-2-carboxamide Formula: C17H13ClN2OS2 MolecularWeight: 360.88092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H13ClN2OS2/c18-14-12-8-4-5-9-13(12)23-15(14)16(21)20-17(22)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,19,20,21,22)