4-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine

Systemtic Name: 4-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Openeye Name: 4-[1-[(3-fluorophenyl)methyl]-3-piperidyl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine CAS Name: 4-[1-[(3-fluorophenyl)methyl]-3-piperidinyl]-2-[2-(1-pyrrolidinyl)ethylthio]pyrimidine IUPAC Name: 4-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Traditional Name: 4-[1-(3-fluorobenzyl)-3-piperidyl]-2-(2-pyrrolidinoethylthio)pyrimidine Formula: C22H29FN4S MolecularWeight: 400.555863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCSC2=NC=CC(=N2)C3CCCN(C3)CC4=CC(=CC=C4)F

Isomeric SMILES

C1CCN(C1)CCSC2=NC=CC(=N2)C3CCCN(C3)CC4=CC(=CC=C4)F

InChI

InChI=1S/C22H29FN4S/c23-20-7-3-5-18(15-20)16-27-12-4-6-19(17-27)21-8-9-24-22(25-21)28-14-13-26-10-1-2-11-26/h3,5,7-9,15,19H,1-2,4,6,10-14,16-17H2