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

Systemtic Name: N-[2-[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isobutyl-3-nitro-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-isobutyl-3-nitro-benzamide Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC(C)C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC(C)C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H33N5O4/c1-18(2)16-30(26(34)20-8-7-9-22(14-20)32(35)36)17-25(33)28-24-15-23(27(4,5)6)29-31(24)21-12-10-19(3)11-13-21/h7-15,18H,16-17H2,1-6H3,(H,28,33)