3-methylsulfanyl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-methylsulfanyl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-methylsulfanyl-1-[(3R)-3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(methylthio)-1-[(3R)-3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-methylsulfanyl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(methylthio)-1-[(3R)-3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]propan-1-one Formula: C17H26N4OS MolecularWeight: 334.47954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CSCCC(=O)N1CC[C@@H](C1)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H26N4OS/c1-23-12-6-16(22)21-11-5-15(13-21)14-3-9-20(10-4-14)17-18-7-2-8-19-17/h2,7-8,14-15H,3-6,9-13H2,1H3/t15-/m0/s1