1-(2,4-dimethoxyphenyl)-3-[3-methyl-1-(3-methyl-4-octanoyl-piperazin-1-yl)-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-(2,4-dimethoxyphenyl)-3-[3-methyl-1-(3-methyl-4-octanoyl-piperazin-1-yl)-1-oxidanylidene-pentan-2-yl]urea Openeye Name: 1-(2,4-dimethoxyphenyl)-3-[2-methyl-1-(3-methyl-4-octanoyl-piperazine-1-carbonyl)butyl]urea CAS Name: 1-(2,4-dimethoxyphenyl)-3-[3-methyl-1-[3-methyl-4-(1-oxooctyl)-1-piperazinyl]-1-oxopentan-2-yl]urea IUPAC Name: 1-(2,4-dimethoxyphenyl)-3-[3-methyl-1-(3-methyl-4-octanoylpiperazin-1-yl)-1-oxopentan-2-yl]urea Traditional Name: 1-[1-(4-caprylyl-3-methyl-piperazine-1-carbonyl)-2-methyl-butyl]-3-(2,4-dimethoxyphenyl)urea Formula: C28H46N4O5 MolecularWeight: 518.68864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C28H46N4O5/c1-7-9-10-11-12-13-25(33)32-17-16-31(19-21(32)4)27(34)26(20(3)8-2)30-28(35)29-23-15-14-22(36-5)18-24(23)37-6/h14-15,18,20-21,26H,7-13,16-17,19H2,1-6H3,(H2,29,30,35)