N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-methyl-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-methyl-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isobutyl-4-methyl-3-nitro-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-4-methyl-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-4-methyl-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-isobutyl-4-methyl-3-nitro-benzamide Formula: C28H35N5O4 MolecularWeight: 505.6086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(C)C)CC(=O)NC2=CC(=NN2C3=CC=CC=C3C)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(C)C)CC(=O)NC2=CC(=NN2C3=CC=CC=C3C)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C28H35N5O4/c1-18(2)16-31(27(35)21-13-12-20(4)23(14-21)33(36)37)17-26(34)29-25-15-24(28(5,6)7)30-32(25)22-11-9-8-10-19(22)3/h8-15,18H,16-17H2,1-7H3,(H,29,34)