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

Systemtic Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isobutyl-3-nitro-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-isobutyl-3-nitro-benzamide Formula: C27H33N5O5 MolecularWeight: 507.58142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H33N5O5/c1-18(2)16-30(26(34)19-8-7-9-21(14-19)32(35)36)17-25(33)28-24-15-23(27(3,4)5)29-31(24)20-10-12-22(37-6)13-11-20/h7-15,18H,16-17H2,1-6H3,(H,28,33)