N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide

Systemtic Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide Openeye Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide CAS Name: N-[4-(methylthio)-1,3-benzothiazol-2-yl]-3-nitrobenzamide IUPAC Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide Traditional Name: N-[4-(methylthio)-1,3-benzothiazol-2-yl]-3-nitro-benzamide Formula: C15H11N3O3S2 MolecularWeight: 345.39614

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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