1-(4-fluorophenyl)-3-[1-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butan-2-yl]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[1-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butan-2-yl]urea Openeye Name: 1-(4-fluorophenyl)-3-[1-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]propyl]urea CAS Name: 1-(4-fluorophenyl)-3-[1-(4-oxo-1,2,3-benzotriazin-3-yl)butan-2-yl]urea IUPAC Name: 1-(4-fluorophenyl)-3-[1-(4-oxo-1,2,3-benzotriazin-3-yl)butan-2-yl]urea Traditional Name: 1-(4-fluorophenyl)-3-[1-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]propyl]urea Formula: C18H18FN5O2 MolecularWeight: 355.366223

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=O)C2=CC=CC=C2N=N1)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCC(CN1C(=O)C2=CC=CC=C2N=N1)NC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN5O2/c1-2-13(20-18(26)21-14-9-7-12(19)8-10-14)11-24-17(25)15-5-3-4-6-16(15)22-23-24/h3-10,13H,2,11H2,1H3,(H2,20,21,26)