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

Systemtic Name: N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-methyl-N-(3-methylbutyl)-3-nitro-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isopentyl-4-methyl-3-nitro-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-4-methyl-N-(3-methylbutyl)-3-nitrobenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-4-methyl-N-(3-methylbutyl)-3-nitrobenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-isoamyl-4-methyl-3-nitro-benzamide Formula: C29H37N5O4 MolecularWeight: 519.63518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37N5O4/c1-19(2)13-14-32(28(36)22-12-11-21(4)24(16-22)34(37)38)18-27(35)30-26-17-25(29(5,6)7)31-33(26)23-10-8-9-20(3)15-23/h8-12,15-17,19H,13-14,18H2,1-7H3,(H,30,35)