2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 2-(3-methoxy-4-nitro-1-pyrazolyl)-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 2-(3-methoxy-4-nitropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[2-(phenylthio)phenyl]propionamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O4S/c1-13(22-12-16(23(25)26)19(21-22)27-2)18(24)20-15-10-6-7-11-17(15)28-14-8-4-3-5-9-14/h3-13H,1-2H3,(H,20,24)