2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-[(1-methylimidazol-2-yl)thio]phenyl]acetamide Formula: C17H18N6O3S MolecularWeight: 386.42822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)SC3=NC=CN3C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)SC3=NC=CN3C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O3S/c1-11-16(23(25)26)12(2)22(20-11)10-15(24)19-13-4-6-14(7-5-13)27-17-18-8-9-21(17)3/h4-9H,10H2,1-3H3,(H,19,24)