1-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]-3-(trifluoromethyl)phenyl]but-3-ynyl]-1-oxidanyl-urea

Systemtic Name: 1-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]-3-(trifluoromethyl)phenyl]but-3-ynyl]-1-oxidanyl-urea Openeye Name: 1-hydroxy-1-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]-3-(trifluoromethyl)phenyl]but-3-ynyl]urea CAS Name: 1-hydroxy-1-[4-[4-[2-(4-methyl-1-piperazinyl)ethoxy]-3-(trifluoromethyl)phenyl]but-3-ynyl]urea IUPAC Name: 1-hydroxy-1-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]-3-(trifluoromethyl)phenyl]but-3-ynyl]urea Traditional Name: 1-hydroxy-1-[4-[4-[2-(4-methylpiperazino)ethoxy]-3-(trifluoromethyl)phenyl]but-3-ynyl]urea Formula: C19H25F3N4O3 MolecularWeight: 414.42201

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCOC2=C(C=C(C=C2)C#CCCN(C(=O)N)O)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)CCOC2=C(C=C(C=C2)C#CCCN(C(=O)N)O)C(F)(F)F

InChI

InChI=1S/C19H25F3N4O3/c1-24-8-10-25(11-9-24)12-13-29-17-6-5-15(14-16(17)19(20,21)22)4-2-3-7-26(28)18(23)27/h5-6,14,28H,3,7-13H2,1H3,(H2,23,27)