[4-(2-tert-butyl-5-methyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-[4-(3-piperidin-1-ylpropoxy)phenyl]methanone

Systemtic Name: [4-(2-tert-butyl-5-methyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-[4-(3-piperidin-1-ylpropoxy)phenyl]methanone Openeye Name: [4-(2-tert-butyl-5-methyl-pyrazole-3-carbonyl)piperazin-1-yl]-[4-[3-(1-piperidyl)propoxy]phenyl]methanone CAS Name: [4-[(2-tert-butyl-5-methyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]-[4-[3-(1-piperidinyl)propoxy]phenyl]methanone IUPAC Name: [4-(2-tert-butyl-5-methylpyrazole-3-carbonyl)piperazin-1-yl]-[4-(3-piperidin-1-ylpropoxy)phenyl]methanone Traditional Name: [4-(2-tert-butyl-5-methyl-pyrazole-3-carbonyl)piperazino]-[4-(3-piperidinopropoxy)phenyl]methanone Formula: C28H41N5O3 MolecularWeight: 495.65684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCCCN4CCCCC4)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCCCN4CCCCC4)C(C)(C)C

InChI

InChI=1S/C28H41N5O3/c1-22-21-25(33(29-22)28(2,3)4)27(35)32-18-16-31(17-19-32)26(34)23-9-11-24(12-10-23)36-20-8-15-30-13-6-5-7-14-30/h9-12,21H,5-8,13-20H2,1-4H3