N,N'-bis[(E)-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)methylideneamino]pentanediamide

Systemtic Name: N,N'-bis[(E)-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)methylideneamino]pentanediamide Openeye Name: N,N'-bis[(E)-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyleneamino]pentanediamide CAS Name: N,N'-bis[(E)-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)methylideneamino]pentanediamide IUPAC Name: N,N'-bis[(E)-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)methylideneamino]pentanediamide Traditional Name: N,N'-bis[(E)-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)methyleneamino]glutaramide Formula: C29H32N8O4 MolecularWeight: 556.61558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=NNC(=O)CCCC(=O)NN=CC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)/C=N/NC(=O)CCCC(=O)N/N=C/C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C29H32N8O4/c1-20-24(28(40)36(34(20)3)22-12-7-5-8-13-22)18-30-32-26(38)16-11-17-27(39)33-31-19-25-21(2)35(4)37(29(25)41)23-14-9-6-10-15-23/h5-10,12-15,18-19H,11,16-17H2,1-4H3,(H,32,38)(H,33,39)/b30-18+,31-19+