N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(4-chlorophenyl)ethanamide

Systemtic Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: N-[[2-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C22H16ClN3OS2 MolecularWeight: 437.96494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN3OS2/c23-15-11-9-14(10-12-15)13-20(27)26-22(28)25-17-6-2-1-5-16(17)21-24-18-7-3-4-8-19(18)29-21/h1-12H,13H2,(H2,25,26,27,28)