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

Systemtic Name: N-[2-[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-3-nitro-N-propyl-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-3-nitro-N-propylbenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-3-nitro-N-propylbenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-3-nitro-N-propyl-benzamide Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N5O4/c1-6-14-29(25(33)19-8-7-9-21(15-19)31(34)35)17-24(32)27-23-16-22(26(3,4)5)28-30(23)20-12-10-18(2)11-13-20/h7-13,15-16H,6,14,17H2,1-5H3,(H,27,32)