2-(4-chlorophenyl)-N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[(6-nitro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[(6-nitro-1,3-benzothiazol-2-yl)thiocarbamoyl]acetamide Formula: C16H11ClN4O3S2 MolecularWeight: 406.86654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H11ClN4O3S2/c17-10-3-1-9(2-4-10)7-14(22)19-15(25)20-16-18-12-6-5-11(21(23)24)8-13(12)26-16/h1-6,8H,7H2,(H2,18,19,20,22,25)