1-tert-butyl-3-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]urea

Systemtic Name: 1-tert-butyl-3-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]urea Openeye Name: 1-tert-butyl-3-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]urea CAS Name: 1-tert-butyl-3-[2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl]urea IUPAC Name: 1-tert-butyl-3-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]urea Traditional Name: 1-tert-butyl-3-[2-[4-(4-fluorophenyl)piperazino]ethyl]urea Formula: C17H27FN4O MolecularWeight: 322.420883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NCCN1CCN(CC1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)NC(=O)NCCN1CCN(CC1)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H27FN4O/c1-17(2,3)20-16(23)19-8-9-21-10-12-22(13-11-21)15-6-4-14(18)5-7-15/h4-7H,8-13H2,1-3H3,(H2,19,20,23)