5-[4-[(2-fluorophenyl)methylsulfanyl]piperidin-1-yl]-6-methyl-1-[(2-methylpropan-2-yl)oxy]-2H-pyrazine

Systemtic Name: 5-[4-[(2-fluorophenyl)methylsulfanyl]piperidin-1-yl]-6-methyl-1-[(2-methylpropan-2-yl)oxy]-2H-pyrazine Openeye Name: 1-tert-butoxy-5-[4-[(2-fluorophenyl)methylsulfanyl]-1-piperidyl]-6-methyl-2H-pyrazine CAS Name: 5-[4-[(2-fluorophenyl)methylthio]-1-piperidinyl]-6-methyl-1-[(2-methylpropan-2-yl)oxy]-2H-pyrazine IUPAC Name: 5-[4-[(2-fluorophenyl)methylsulfanyl]piperidin-1-yl]-6-methyl-1-[(2-methylpropan-2-yl)oxy]-2H-pyrazine Traditional Name: 1-tert-butoxy-5-[4-[(2-fluorobenzyl)thio]piperidino]-6-methyl-2H-pyrazine Formula: C21H30FN3OS MolecularWeight: 391.545803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CCN1OC(C)(C)C)N2CCC(CC2)SCC3=CC=CC=C3F

Isomeric SMILES

CC1=C(N=CCN1OC(C)(C)C)N2CCC(CC2)SCC3=CC=CC=C3F

InChI

InChI=1S/C21H30FN3OS/c1-16-20(23-11-14-25(16)26-21(2,3)4)24-12-9-18(10-13-24)27-15-17-7-5-6-8-19(17)22/h5-8,11,18H,9-10,12-15H2,1-4H3