1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[3-(3,3-dimethyl-2-oxidanylidene-1-piperidin-4-yl-hexyl)phenyl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[3-(3,3-dimethyl-2-oxidanylidene-1-piperidin-4-yl-hexyl)phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[3-[3,3-dimethyl-2-oxo-1-(4-piperidyl)hexyl]phenyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[3-[3,3-dimethyl-2-oxo-1-(4-piperidinyl)hexyl]phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[3-(3,3-dimethyl-2-oxo-1-piperidin-4-ylhexyl)phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[3-[2-keto-3,3-dimethyl-1-(4-piperidyl)hexyl]phenyl]urea Formula: C34H47N5O2 MolecularWeight: 557.76928

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C(=O)C(C1CCNCC1)C2=CC(=CC=C2)NC(=O)NC3=CC(=NN3C4=CC=C(C=C4)C)C(C)(C)C

Isomeric SMILES

CCCC(C)(C)C(=O)C(C1CCNCC1)C2=CC(=CC=C2)NC(=O)NC3=CC(=NN3C4=CC=C(C=C4)C)C(C)(C)C

InChI

InChI=1S/C34H47N5O2/c1-8-18-34(6,7)31(40)30(24-16-19-35-20-17-24)25-10-9-11-26(21-25)36-32(41)37-29-22-28(33(3,4)5)38-39(29)27-14-12-23(2)13-15-27/h9-15,21-22,24,30,35H,8,16-20H2,1-7H3,(H2,36,37,41)