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

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-nitro-benzamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-nitro-benzamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-3-nitrobenzamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-nitrobenzamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-3-nitro-benzamide Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/c1-17(11-12-6-8-15(22-2)9-7-12)16(19)13-4-3-5-14(10-13)18(20)21/h3-10H,11H2,1-2H3