1-(2-hydroxyethyl)-3-[4-methyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]-1-phenethyl-urea

Systemtic Name: 1-(2-hydroxyethyl)-3-[4-methyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]-1-phenethyl-urea Openeye Name: 1-(2-hydroxyethyl)-3-[3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]-1-phenethyl-urea CAS Name: 1-(2-hydroxyethyl)-3-[4-methyl-1-(4-methyl-1-piperazinyl)-1-oxopentan-2-yl]-1-phenethylurea IUPAC Name: 1-(2-hydroxyethyl)-3-[4-methyl-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-1-phenethylurea Traditional Name: 1-(2-hydroxyethyl)-3-[3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]-1-phenethyl-urea Formula: C22H36N4O3 MolecularWeight: 404.54624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)C)NC(=O)N(CCC2=CC=CC=C2)CCO

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)C)NC(=O)N(CCC2=CC=CC=C2)CCO

InChI

InChI=1S/C22H36N4O3/c1-18(2)17-20(21(28)25-13-11-24(3)12-14-25)23-22(29)26(15-16-27)10-9-19-7-5-4-6-8-19/h4-8,18,20,27H,9-17H2,1-3H3,(H,23,29)