3-cyclopentyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-cyclopentyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-cyclopentyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-cyclopentyl-2-[[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]thio]-6-oxo-4-pyrimidinolate IUPAC Name: 3-cyclopentyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 3-cyclopentyl-2-[[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]thio]-6-keto-pyrimidin-4-olate Formula: C18H19FN3O3S- MolecularWeight: 376.425163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NCC3=CC=C(C=C3)F)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NCC3=CC=C(C=C3)F)[O-]

InChI

InChI=1S/C18H20FN3O3S/c19-13-7-5-12(6-8-13)10-20-16(24)11-26-18-21-15(23)9-17(25)22(18)14-3-1-2-4-14/h5-9,14,25H,1-4,10-11H2,(H,20,24)/p-1