1-(3-dodecoxypropyl)-3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]urea

Systemtic Name: 1-(3-dodecoxypropyl)-3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]urea Openeye Name: 1-(3-dodecoxypropyl)-3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]urea CAS Name: 1-(3-dodecoxypropyl)-3-[[6-methyl-2-(trifluoromethyl)-4-quinazolinyl]amino]urea IUPAC Name: 1-(3-dodecoxypropyl)-3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]urea Traditional Name: 1-(3-lauryloxypropyl)-3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]urea Formula: C26H40F3N5O2 MolecularWeight: 511.62331

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCCCNC(=O)NNC1=NC(=NC2=C1C=C(C=C2)C)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCOCCCNC(=O)NNC1=NC(=NC2=C1C=C(C=C2)C)C(F)(F)F

InChI

InChI=1S/C26H40F3N5O2/c1-3-4-5-6-7-8-9-10-11-12-17-36-18-13-16-30-25(35)34-33-23-21-19-20(2)14-15-22(21)31-24(32-23)26(27,28)29/h14-15,19H,3-13,16-18H2,1-2H3,(H2,30,34,35)(H,31,32,33)