N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-nitro-benzamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-nitro-benzamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-nitro-benzamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3-nitrobenzamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-nitrobenzamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3-nitro-benzamide Formula: C15H11N3O3S2 MolecularWeight: 345.39614

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O3S2/c1-22-15-17-12-6-5-10(8-13(12)23-15)16-14(19)9-3-2-4-11(7-9)18(20)21/h2-8H,1H3,(H,16,19)