N-(2-ethylsulfanylphenyl)-4-methyl-3-nitro-benzamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-4-methyl-3-nitro-benzamide Openeye Name: N-(2-ethylsulfanylphenyl)-4-methyl-3-nitro-benzamide CAS Name: N-[2-(ethylthio)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-(2-ethylsulfanylphenyl)-4-methyl-3-nitrobenzamide Traditional Name: N-[2-(ethylthio)phenyl]-4-methyl-3-nitro-benzamide Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O3S/c1-3-22-15-7-5-4-6-13(15)17-16(19)12-9-8-11(2)14(10-12)18(20)21/h4-10H,3H2,1-2H3,(H,17,19)