2-methylsulfanyl-1-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-methylsulfanyl-1-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]ethanone Openeye Name: 2-methylsulfanyl-1-[3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(methylthio)-1-[3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]ethanone IUPAC Name: 2-methylsulfanyl-1-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(methylthio)-1-[3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]ethanone Formula: C16H24N4OS MolecularWeight: 320.45296

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)N1CCC(C1)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CSCC(=O)N1CCC(C1)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H24N4OS/c1-22-12-15(21)20-10-5-14(11-20)13-3-8-19(9-4-13)16-17-6-2-7-18-16/h2,6-7,13-14H,3-5,8-12H2,1H3