1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(1-methylsulfonylpiperidin-4-yl)urea

Systemtic Name: 1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(1-methylsulfonylpiperidin-4-yl)urea Openeye Name: 1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(1-methylsulfonyl-4-piperidyl)urea CAS Name: 1-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-3-(1-methylsulfonyl-4-piperidinyl)urea IUPAC Name: 1-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-3-(1-methylsulfonylpiperidin-4-yl)urea Traditional Name: 1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(1-mesyl-4-piperidyl)urea Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CCNC(=O)NC2CCN(CC2)S(=O)(=O)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CCNC(=O)NC2CCN(CC2)S(=O)(=O)C)C)C(C)(C)C

InChI

InChI=1S/C21H35N3O3S/c1-15-13-17(21(3,4)5)14-16(2)19(15)7-10-22-20(25)23-18-8-11-24(12-9-18)28(6,26)27/h13-14,18H,7-12H2,1-6H3,(H2,22,23,25)