2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[5-(2-furyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-[5-(2-furanyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[3-(2-furyl)-5-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C18H17N5O4S MolecularWeight: 399.42368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2C(CC(=N2)C3=CC=CO3)C4=CC=CS4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2C(CC(=N2)C3=CC=CO3)C4=CC=CS4)C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O4S/c1-11-18(23(25)26)12(2)21(19-11)10-17(24)22-14(16-6-4-8-28-16)9-13(20-22)15-5-3-7-27-15/h3-8,14H,9-10H2,1-2H3