4-[1-(furan-3-ylmethyl)piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine

Systemtic Name: 4-[1-(furan-3-ylmethyl)piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Openeye Name: 4-[1-(3-furylmethyl)-3-piperidyl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine CAS Name: 4-[1-(3-furanylmethyl)-3-piperidinyl]-2-[2-(1-pyrrolidinyl)ethylthio]pyrimidine IUPAC Name: 4-[1-(furan-3-ylmethyl)piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Traditional Name: 4-[1-(3-furfuryl)-3-piperidyl]-2-(2-pyrrolidinoethylthio)pyrimidine Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4OS/c1-2-9-23(8-1)11-13-26-20-21-7-5-19(22-20)18-4-3-10-24(15-18)14-17-6-12-25-16-17/h5-7,12,16,18H,1-4,8-11,13-15H2