[3-cyclopropyl-5-ethyl-1-(4-nitrophenyl)pyrazol-4-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [3-cyclopropyl-5-ethyl-1-(4-nitrophenyl)pyrazol-4-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [3-cyclopropyl-5-ethyl-1-(4-nitrophenyl)pyrazol-4-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [3-cyclopropyl-5-ethyl-1-(4-nitrophenyl)-4-pyrazolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [3-cyclopropyl-5-ethyl-1-(4-nitrophenyl)pyrazol-4-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [3-cyclopropyl-5-ethyl-1-(4-nitrophenyl)pyrazol-4-yl]-(4-methylpiperazino)methanone Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3CC3)C(=O)N4CCN(CC4)C

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3CC3)C(=O)N4CCN(CC4)C

InChI

InChI=1S/C20H25N5O3/c1-3-17-18(20(26)23-12-10-22(2)11-13-23)19(14-4-5-14)21-24(17)15-6-8-16(9-7-15)25(27)28/h6-9,14H,3-5,10-13H2,1-2H3