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

Systemtic Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(3-methylbutyl)-3-nitro-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isopentyl-3-nitro-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-(3-methylbutyl)-3-nitrobenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-(3-methylbutyl)-3-nitrobenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-isoamyl-3-nitro-benzamide Formula: C28H35N5O5 MolecularWeight: 521.608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(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)CCN(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/C28H35N5O5/c1-19(2)14-15-31(27(35)20-8-7-9-22(16-20)33(36)37)18-26(34)29-25-17-24(28(3,4)5)30-32(25)21-10-12-23(38-6)13-11-21/h7-13,16-17,19H,14-15,18H2,1-6H3,(H,29,34)