1-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-3-(2-fluorophenyl)urea

Systemtic Name: 1-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-3-(2-fluorophenyl)urea Openeye Name: 1-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-3-(2-fluorophenyl)urea CAS Name: 1-[2-(4-dimethylaminophenyl)-2-(4-methyl-1-piperazinyl)ethyl]-3-(2-fluorophenyl)urea IUPAC Name: 1-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-3-(2-fluorophenyl)urea Traditional Name: 1-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazino)ethyl]-3-(2-fluorophenyl)urea Formula: C22H30FN5O MolecularWeight: 399.504903

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)NC2=CC=CC=C2F)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)NC2=CC=CC=C2F)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H30FN5O/c1-26(2)18-10-8-17(9-11-18)21(28-14-12-27(3)13-15-28)16-24-22(29)25-20-7-5-4-6-19(20)23/h4-11,21H,12-16H2,1-3H3,(H2,24,25,29)