1-(4-carbamimidoylphenyl)-3-[2-[1-[3-(trifluoromethyl)phenyl]ethylamino]cyclohexyl]urea

Systemtic Name: 1-(4-carbamimidoylphenyl)-3-[2-[1-[3-(trifluoromethyl)phenyl]ethylamino]cyclohexyl]urea Openeye Name: 1-(4-carbamimidoylphenyl)-3-[2-[1-[3-(trifluoromethyl)phenyl]ethylamino]cyclohexyl]urea CAS Name: 1-(4-carbamimidoylphenyl)-3-[2-[1-[3-(trifluoromethyl)phenyl]ethylamino]cyclohexyl]urea IUPAC Name: 1-(4-carbamimidoylphenyl)-3-[2-[1-[3-(trifluoromethyl)phenyl]ethylamino]cyclohexyl]urea Traditional Name: 1-(4-amidinophenyl)-3-[2-[1-[3-(trifluoromethyl)phenyl]ethylamino]cyclohexyl]urea Formula: C23H28F3N5O MolecularWeight: 447.49653

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)C(F)(F)F)NC2CCCCC2NC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C1=CC(=CC=C1)C(F)(F)F)NC2CCCCC2NC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H28F3N5O/c1-14(16-5-4-6-17(13-16)23(24,25)26)29-19-7-2-3-8-20(19)31-22(32)30-18-11-9-15(10-12-18)21(27)28/h4-6,9-14,19-20,29H,2-3,7-8H2,1H3,(H3,27,28)(H2,30,31,32)