[4-(1-tert-butyl-5-methyl-pyrazol-4-yl)carbonylpiperazin-1-yl]-(4-chlorophenyl)methanone

Systemtic Name: [4-(1-tert-butyl-5-methyl-pyrazol-4-yl)carbonylpiperazin-1-yl]-(4-chlorophenyl)methanone Openeye Name: [4-(1-tert-butyl-5-methyl-pyrazole-4-carbonyl)piperazin-1-yl]-(4-chlorophenyl)methanone CAS Name: [4-[(1-tert-butyl-5-methyl-4-pyrazolyl)-oxomethyl]-1-piperazinyl]-(4-chlorophenyl)methanone IUPAC Name: [4-(1-tert-butyl-5-methylpyrazole-4-carbonyl)piperazin-1-yl]-(4-chlorophenyl)methanone Traditional Name: [4-(1-tert-butyl-5-methyl-pyrazole-4-carbonyl)piperazino]-(4-chlorophenyl)methanone Formula: C20H25ClN4O2 MolecularWeight: 388.8911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C(C)(C)C)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=NN1C(C)(C)C)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN4O2/c1-14-17(13-22-25(14)20(2,3)4)19(27)24-11-9-23(10-12-24)18(26)15-5-7-16(21)8-6-15/h5-8,13H,9-12H2,1-4H3