1-(4-fluorophenyl)-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]urea Openeye Name: 1-[3-(4-benzylpiperazin-1-yl)propanoylamino]-3-(4-fluorophenyl)urea CAS Name: 1-(4-fluorophenyl)-3-[[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]amino]urea IUPAC Name: 1-[3-(4-benzylpiperazin-1-yl)propanoylamino]-3-(4-fluorophenyl)urea Traditional Name: 1-[3-(4-benzylpiperazino)propanoylamino]-3-(4-fluorophenyl)urea Formula: C21H26FN5O2 MolecularWeight: 399.461843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NNC(=O)NC2=CC=C(C=C2)F)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC(=O)NNC(=O)NC2=CC=C(C=C2)F)CC3=CC=CC=C3

InChI

InChI=1S/C21H26FN5O2/c22-18-6-8-19(9-7-18)23-21(29)25-24-20(28)10-11-26-12-14-27(15-13-26)16-17-4-2-1-3-5-17/h1-9H,10-16H2,(H,24,28)(H2,23,25,29)