1-[[5-methyl-2-(3-methylbutyl)-2-oxidanyl-hexanoyl]amino]-1,3-diphenyl-urea

Systemtic Name: 1-[[5-methyl-2-(3-methylbutyl)-2-oxidanyl-hexanoyl]amino]-1,3-diphenyl-urea Openeye Name: 1-[(2-hydroxy-2-isopentyl-5-methyl-hexanoyl)amino]-1,3-diphenyl-urea CAS Name: 1-[[2-hydroxy-5-methyl-2-(3-methylbutyl)-1-oxohexyl]amino]-1,3-diphenylurea IUPAC Name: 1-[[2-hydroxy-5-methyl-2-(3-methylbutyl)hexanoyl]amino]-1,3-diphenylurea Traditional Name: 1-[(2-hydroxy-2-isoamyl-5-methyl-hexanoyl)amino]-1,3-diphenyl-urea Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CCC(C)C)(C(=O)NN(C1=CC=CC=C1)C(=O)NC2=CC=CC=C2)O

Isomeric SMILES

CC(C)CCC(CCC(C)C)(C(=O)NN(C1=CC=CC=C1)C(=O)NC2=CC=CC=C2)O

InChI

InChI=1S/C25H35N3O3/c1-19(2)15-17-25(31,18-16-20(3)4)23(29)27-28(22-13-9-6-10-14-22)24(30)26-21-11-7-5-8-12-21/h5-14,19-20,31H,15-18H2,1-4H3,(H,26,30)(H,27,29)