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

Systemtic Name: 4-[1-(furan-2-ylmethyl)piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Openeye Name: 4-[1-(2-furylmethyl)-3-piperidyl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine CAS Name: 4-[1-(2-furanylmethyl)-3-piperidinyl]-2-[2-(1-pyrrolidinyl)ethylthio]pyrimidine IUPAC Name: 4-[1-(furan-2-ylmethyl)piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Traditional Name: 4-[1-(2-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=CC=CO4

Isomeric SMILES

C1CCN(C1)CCSC2=NC=CC(=N2)C3CCCN(C3)CC4=CC=CO4

InChI

InChI=1S/C20H28N4OS/c1-2-10-23(9-1)12-14-26-20-21-8-7-19(22-20)17-5-3-11-24(15-17)16-18-6-4-13-25-18/h4,6-8,13,17H,1-3,5,9-12,14-16H2