2-[[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperidin-1-yl]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperidin-1-yl]methyl]-1,3-benzothiazole Openeye Name: 2-[[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]-1-piperidyl]methyl]-1,3-benzothiazole CAS Name: 2-[[3-[5-(4-fluorophenyl)-2-methyl-4-pyrimidinyl]-1-piperidinyl]methyl]-1,3-benzothiazole IUPAC Name: 2-[[3-[5-(4-fluorophenyl)-2-methylpyrimidin-4-yl]piperidin-1-yl]methyl]-1,3-benzothiazole Traditional Name: 2-[[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperidino]methyl]-1,3-benzothiazole Formula: C24H23FN4S MolecularWeight: 418.529623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)C2CCCN(C2)CC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=NC=C(C(=N1)C2CCCN(C2)CC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H23FN4S/c1-16-26-13-20(17-8-10-19(25)11-9-17)24(27-16)18-5-4-12-29(14-18)15-23-28-21-6-2-3-7-22(21)30-23/h2-3,6-11,13,18H,4-5,12,14-15H2,1H3