5-ethyl-3-[2-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]piperidin-1-yl]-4-oxidanyl-1,4-dihydropyrimidine-2-thione

Systemtic Name: 5-ethyl-3-[2-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]piperidin-1-yl]-4-oxidanyl-1,4-dihydropyrimidine-2-thione Openeye Name: 5-ethyl-3-[2-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]-1-piperidyl]-4-hydroxy-1,4-dihydropyrimidine-2-thione CAS Name: 5-ethyl-3-[2-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]-1-piperidinyl]-4-hydroxy-1,4-dihydropyrimidine-2-thione IUPAC Name: 5-ethyl-3-[2-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]piperidin-1-yl]-4-hydroxy-1,4-dihydropyrimidine-2-thione Traditional Name: 5-ethyl-3-[2-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]piperidino]-4-hydroxy-1,4-dihydropyrimidine-2-thione Formula: C20H26FN3O3S MolecularWeight: 407.502143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CNC(=S)N(C1O)N2CCCCC2C3(OCCO3)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CNC(=S)N(C1O)N2CCCCC2C3(OCCO3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H26FN3O3S/c1-2-14-13-22-19(28)24(18(14)25)23-10-4-3-5-17(23)20(26-11-12-27-20)15-6-8-16(21)9-7-15/h6-9,13,17-18,25H,2-5,10-12H2,1H3,(H,22,28)