2-tert-butyl-4-cyclobutyl-6-[4-[3-(5-fluoranylpyrimidin-2-yl)sulfanylpropyl]piperazin-1-yl]pyrimidine

Systemtic Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-(5-fluoranylpyrimidin-2-yl)sulfanylpropyl]piperazin-1-yl]pyrimidine Openeye Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-(5-fluoropyrimidin-2-yl)sulfanylpropyl]piperazin-1-yl]pyrimidine CAS Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-[(5-fluoro-2-pyrimidinyl)thio]propyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-(5-fluoropyrimidin-2-yl)sulfanylpropyl]piperazin-1-yl]pyrimidine Traditional Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-[(5-fluoropyrimidin-2-yl)thio]propyl]piperazino]pyrimidine Formula: C23H33FN6S MolecularWeight: 444.611723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NC=C(C=N3)F)C4CCC4

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NC=C(C=N3)F)C4CCC4

InChI

InChI=1S/C23H33FN6S/c1-23(2,3)21-27-19(17-6-4-7-17)14-20(28-21)30-11-9-29(10-12-30)8-5-13-31-22-25-15-18(24)16-26-22/h14-17H,4-13H2,1-3H3