N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-nitro-benzamide CAS Name: N-[(1,3-benzothiazol-2-ylamino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-ylthiocarbamoyl)-2-nitro-benzamide Formula: C15H10N4O3S2 MolecularWeight: 358.3949

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O3S2/c20-13(9-5-1-3-7-11(9)19(21)22)17-14(23)18-15-16-10-6-2-4-8-12(10)24-15/h1-8H,(H2,16,17,18,20,23)