1-(3-methoxyphenyl)-3-[3-methyl-1-(4-octanoylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-(3-methoxyphenyl)-3-[3-methyl-1-(4-octanoylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]urea Openeye Name: 1-(3-methoxyphenyl)-3-[2-methyl-1-(4-octanoylpiperazine-1-carbonyl)butyl]urea CAS Name: 1-(3-methoxyphenyl)-3-[3-methyl-1-oxo-1-[4-(1-oxooctyl)-1-piperazinyl]pentan-2-yl]urea IUPAC Name: 1-(3-methoxyphenyl)-3-[3-methyl-1-(4-octanoylpiperazin-1-yl)-1-oxopentan-2-yl]urea Traditional Name: 1-[1-(4-caprylylpiperazine-1-carbonyl)-2-methyl-butyl]-3-(3-methoxyphenyl)urea Formula: C26H42N4O4 MolecularWeight: 474.63608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C(=O)C(C(C)CC)NC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C(=O)C(C(C)CC)NC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C26H42N4O4/c1-5-7-8-9-10-14-23(31)29-15-17-30(18-16-29)25(32)24(20(3)6-2)28-26(33)27-21-12-11-13-22(19-21)34-4/h11-13,19-20,24H,5-10,14-18H2,1-4H3,(H2,27,28,33)