2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(E)-(4-methylsulfanylphenyl)methyleneamino]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[(E)-[4-(methylthio)phenyl]methylideneamino]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(E)-[4-(methylthio)benzylidene]amino]acetamide Formula: C15H17N5O3S MolecularWeight: 347.39218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NN=CC2=CC=C(C=C2)SC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N/N=C/C2=CC=C(C=C2)SC)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O3S/c1-10-15(20(22)23)11(2)19(18-10)9-14(21)17-16-8-12-4-6-13(24-3)7-5-12/h4-8H,9H2,1-3H3,(H,17,21)/b16-8+