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

Systemtic Name: 4-methylsulfanyl-N-(4-methyl-1,3-thiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-methylsulfanyl-N-(4-methylthiazol-2-yl)-3-nitro-benzamide CAS Name: N-(4-methyl-2-thiazolyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: 4-methylsulfanyl-N-(4-methyl-1,3-thiazol-2-yl)-3-nitrobenzamide Traditional Name: N-(4-methylthiazol-2-yl)-4-(methylthio)-3-nitro-benzamide Formula: C12H11N3O3S2 MolecularWeight: 309.36404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O3S2/c1-7-6-20-12(13-7)14-11(16)8-3-4-10(19-2)9(5-8)15(17)18/h3-6H,1-2H3,(H,13,14,16)