3-[5-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-4,4-dimethyl-pentyl]-1,1-dimethyl-urea

Systemtic Name: 3-[5-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-4,4-dimethyl-pentyl]-1,1-dimethyl-urea Openeye Name: 3-[5-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]-4,4-dimethyl-pentyl]-1,1-dimethyl-urea CAS Name: 3-[5-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-4,4-dimethylpentyl]-1,1-dimethylurea IUPAC Name: 3-[5-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-4,4-dimethylpentyl]-1,1-dimethylurea Traditional Name: 3-[5-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]-4,4-dimethyl-pentyl]-1,1-dimethyl-urea Formula: C21H37N3O4S MolecularWeight: 427.60118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)(C)CCCNC(=O)N(C)C)S(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)CN(CC(C)(C)CCCNC(=O)N(C)C)S(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C21H37N3O4S/c1-17(2)15-24(29(26,27)19-11-9-18(28-7)10-12-19)16-21(3,4)13-8-14-22-20(25)23(5)6/h9-12,17H,8,13-16H2,1-7H3,(H,22,25)