2-bromanyl-N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]-5-nitro-benzamide

Systemtic Name: 2-bromanyl-N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]-5-nitro-benzamide Openeye Name: 2-bromo-N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-5-nitro-benzamide CAS Name: 2-bromo-N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-5-nitrobenzamide IUPAC Name: 2-bromo-N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-5-nitrobenzamide Traditional Name: 2-bromo-N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-5-nitro-benzamide Formula: C15H8BrClN4O3S2 MolecularWeight: 471.73602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H8BrClN4O3S2/c16-10-3-2-8(21(23)24)6-9(10)13(22)19-14(25)20-15-18-11-4-1-7(17)5-12(11)26-15/h1-6H,(H2,18,19,20,22,25)