1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[2-(2-cycloheptyl-2-oxidanylidene-1-piperidin-4-yl-ethyl)phenyl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[2-(2-cycloheptyl-2-oxidanylidene-1-piperidin-4-yl-ethyl)phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[2-[2-cycloheptyl-2-oxo-1-(4-piperidyl)ethyl]phenyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[2-[2-cycloheptyl-2-oxo-1-(4-piperidinyl)ethyl]phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[2-(2-cycloheptyl-2-oxo-1-piperidin-4-ylethyl)phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[2-[2-cycloheptyl-2-keto-1-(4-piperidyl)ethyl]phenyl]urea Formula: C35H47N5O2 MolecularWeight: 569.77998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=CC=C3C(C4CCNCC4)C(=O)C5CCCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=CC=C3C(C4CCNCC4)C(=O)C5CCCCCC5

InChI

InChI=1S/C35H47N5O2/c1-24-15-17-27(18-16-24)40-31(23-30(39-40)35(2,3)4)38-34(42)37-29-14-10-9-13-28(29)32(25-19-21-36-22-20-25)33(41)26-11-7-5-6-8-12-26/h9-10,13-18,23,25-26,32,36H,5-8,11-12,19-22H2,1-4H3,(H2,37,38,42)