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

Systemtic Name: N-[2-[[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-isobutyl-3-nitro-N-[2-oxo-2-[[5-phenyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]benzamide CAS Name: N-[2-[[2-(4-methylphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[2-[[2-(4-methylphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-isobutyl-N-[2-keto-2-[[5-phenyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]-3-nitro-benzamide Formula: C29H29N5O4 MolecularWeight: 511.57166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)NC(=O)CN(CC(C)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)NC(=O)CN(CC(C)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H29N5O4/c1-20(2)18-32(29(36)23-10-7-11-25(16-23)34(37)38)19-28(35)30-27-17-26(22-8-5-4-6-9-22)31-33(27)24-14-12-21(3)13-15-24/h4-17,20H,18-19H2,1-3H3,(H,30,35)