1-[(E)-4-cyclopentyl-3-fluoranyl-4-(5-methyl-1,2,3,4-tetrazol-1-yl)-2-oxidanylidene-but-3-enyl]urea

Systemtic Name: 1-[(E)-4-cyclopentyl-3-fluoranyl-4-(5-methyl-1,2,3,4-tetrazol-1-yl)-2-oxidanylidene-but-3-enyl]urea Openeye Name: [(E)-4-cyclopentyl-3-fluoro-4-(5-methyltetrazol-1-yl)-2-oxo-but-3-enyl]urea CAS Name: [(E)-4-cyclopentyl-3-fluoro-4-(5-methyl-1-tetrazolyl)-2-oxobut-3-enyl]urea IUPAC Name: [(E)-4-cyclopentyl-3-fluoro-4-(5-methyltetrazol-1-yl)-2-oxobut-3-enyl]urea Traditional Name: [(E)-4-cyclopentyl-3-fluoro-2-keto-4-(5-methyltetrazol-1-yl)but-3-enyl]urea Formula: C12H17FN6O2 MolecularWeight: 296.300783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=NN1C(=C(C(=O)CNC(=O)N)F)C2CCCC2

Isomeric SMILES

CC1=NN=NN1/C(=C(\C(=O)CNC(=O)N)/F)/C2CCCC2

InChI

InChI=1S/C12H17FN6O2/c1-7-16-17-18-19(7)11(8-4-2-3-5-8)10(13)9(20)6-15-12(14)21/h8H,2-6H2,1H3,(H3,14,15,21)/b11-10+