1-(3-methoxyphenyl)-3-[1-(3-methyl-4-octanoyl-piperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]urea

Systemtic Name: 1-(3-methoxyphenyl)-3-[1-(3-methyl-4-octanoyl-piperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]urea Openeye Name: 1-[1-benzyl-2-(3-methyl-4-octanoyl-piperazin-1-yl)-2-oxo-ethyl]-3-(3-methoxyphenyl)urea CAS Name: 1-(3-methoxyphenyl)-3-[1-[3-methyl-4-(1-oxooctyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]urea IUPAC Name: 1-(3-methoxyphenyl)-3-[1-(3-methyl-4-octanoylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]urea Traditional Name: 1-[1-benzyl-2-(4-caprylyl-3-methyl-piperazino)-2-keto-ethyl]-3-(3-methoxyphenyl)urea Formula: C30H42N4O4 MolecularWeight: 522.67888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1C)C(=O)C(CC2=CC=CC=C2)NC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1C)C(=O)C(CC2=CC=CC=C2)NC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C30H42N4O4/c1-4-5-6-7-11-17-28(35)34-19-18-33(22-23(34)2)29(36)27(20-24-13-9-8-10-14-24)32-30(37)31-25-15-12-16-26(21-25)38-3/h8-10,12-16,21,23,27H,4-7,11,17-20,22H2,1-3H3,(H2,31,32,37)