3-methyl-N-(3-methylsulfanylphenyl)-4-nitro-benzamide

Systemtic Name: 3-methyl-N-(3-methylsulfanylphenyl)-4-nitro-benzamide Openeye Name: 3-methyl-N-(3-methylsulfanylphenyl)-4-nitro-benzamide CAS Name: 3-methyl-N-[3-(methylthio)phenyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-(3-methylsulfanylphenyl)-4-nitrobenzamide Traditional Name: 3-methyl-N-[3-(methylthio)phenyl]-4-nitro-benzamide Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC(=CC=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC(=CC=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O3S/c1-10-8-11(6-7-14(10)17(19)20)15(18)16-12-4-3-5-13(9-12)21-2/h3-9H,1-2H3,(H,16,18)