1-[(4-tert-butylphenyl)methyl]-1-methyl-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-1-methyl-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-1-methyl-3-[[4-(1-piperidylsulfonyl)phenyl]methyl]urea CAS Name: 1-[(4-tert-butylphenyl)methyl]-1-methyl-3-[[4-(1-piperidinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-1-methyl-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(4-tert-butylbenzyl)-1-methyl-3-(4-piperidinosulfonylbenzyl)urea Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(C)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(C)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C25H35N3O3S/c1-25(2,3)22-12-8-21(9-13-22)19-27(4)24(29)26-18-20-10-14-23(15-11-20)32(30,31)28-16-6-5-7-17-28/h8-15H,5-7,16-19H2,1-4H3,(H,26,29)