N-(2,3-dimethyl-6-nitro-phenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide

Systemtic Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide Openeye Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]acetamide CAS Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]acetamide IUPAC Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]acetamide Traditional Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]acetamide Formula: C25H28N6O4 MolecularWeight: 476.52762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H28N6O4/c1-15-10-11-20(31(34)35)23(16(15)2)27-21(32)14-29-13-12-26-25(33)24(29)22-17(3)28-30(18(22)4)19-8-6-5-7-9-19/h5-11,24H,12-14H2,1-4H3,(H,26,33)(H,27,32)