1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-methylsulfonylpiperidin-4-yl)methyl]phenyl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-methylsulfonylpiperidin-4-yl)methyl]phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[(1-methylsulfonyl-4-piperidyl)methyl]phenyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[(1-methylsulfonyl-4-piperidinyl)methyl]phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-methylsulfonylpiperidin-4-yl)methyl]phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[(1-mesyl-4-piperidyl)methyl]phenyl]urea Formula: C28H37N5O3S MolecularWeight: 523.69008

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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=C(C=C3)CC4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)CC4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C28H37N5O3S/c1-20-6-12-24(13-7-20)33-26(19-25(31-33)28(2,3)4)30-27(34)29-23-10-8-21(9-11-23)18-22-14-16-32(17-15-22)37(5,35)36/h6-13,19,22H,14-18H2,1-5H3,(H2,29,30,34)