N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-benzamide

Systemtic Name: N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-benzamide Openeye Name: N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-3-nitro-N-propyl-benzamide CAS Name: N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-3-nitro-N-propylbenzamide IUPAC Name: N-[2-[[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-3-nitro-N-propylbenzamide Traditional Name: N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-3-nitro-N-propyl-benzamide Formula: C29H29N5O4 MolecularWeight: 511.57166

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H29N5O4/c1-4-15-32(29(36)23-11-8-12-24(17-23)34(37)38)19-28(35)30-27-18-25(22-9-6-5-7-10-22)31-33(27)26-14-13-20(2)16-21(26)3/h5-14,16-18H,4,15,19H2,1-3H3,(H,30,35)