2-(4-nitropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 2-(4-nitropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 2-(4-nitropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 2-(4-nitro-1-pyrazolyl)-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 2-(4-nitropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 2-(4-nitropyrazol-1-yl)-N-[2-(phenylthio)phenyl]propionamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)N3C=C(C=N3)[N+](=O)[O-]

InChI

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