1-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluorophenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluorophenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluorophenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluorophenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluorophenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]urea Traditional Name: 3-(2-fluorophenyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-1-piperonyl-urea Formula: C26H22FN3O4 MolecularWeight: 459.468983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=CC=C5F

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=CC=C5F

InChI

InChI=1S/C26H22FN3O4/c1-16-6-8-21-18(10-16)12-19(25(31)28-21)14-30(26(32)29-22-5-3-2-4-20(22)27)13-17-7-9-23-24(11-17)34-15-33-23/h2-12H,13-15H2,1H3,(H,28,31)(H,29,32)