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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33N5O4/c1-7-13-30(26(34)20-12-11-19(3)22(15-20)32(35)36)17-25(33)28-24-16-23(27(4,5)6)29-31(24)21-10-8-9-18(2)14-21/h8-12,14-16H,7,13,17H2,1-6H3,(H,28,33)