N-(2-methylsulfanylphenyl)-4-[(4-nitropyrazol-1-yl)methyl]benzamide

Systemtic Name: N-(2-methylsulfanylphenyl)-4-[(4-nitropyrazol-1-yl)methyl]benzamide Openeye Name: N-(2-methylsulfanylphenyl)-4-[(4-nitropyrazol-1-yl)methyl]benzamide CAS Name: N-[2-(methylthio)phenyl]-4-[(4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-(2-methylsulfanylphenyl)-4-[(4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[2-(methylthio)phenyl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O3S/c1-26-17-5-3-2-4-16(17)20-18(23)14-8-6-13(7-9-14)11-21-12-15(10-19-21)22(24)25/h2-10,12H,11H2,1H3,(H,20,23)