1-ethoxy-2-[3-(6-pentylnaphthalen-2-yl)propoxy]-1-(2-pyrimidin-2-yloxypropylsulfanyl)ethanol

Systemtic Name: 1-ethoxy-2-[3-(6-pentylnaphthalen-2-yl)propoxy]-1-(2-pyrimidin-2-yloxypropylsulfanyl)ethanol Openeye Name: 1-ethoxy-2-[3-(6-pentyl-2-naphthyl)propoxy]-1-(2-pyrimidin-2-yloxypropylsulfanyl)ethanol CAS Name: 1-ethoxy-2-[3-(6-pentyl-2-naphthalenyl)propoxy]-1-[2-(2-pyrimidinyloxy)propylthio]ethanol IUPAC Name: 1-ethoxy-2-[3-(6-pentylnaphthalen-2-yl)propoxy]-1-(2-pyrimidin-2-yloxypropylsulfanyl)ethanol Traditional Name: 2-[3-(6-amyl-2-naphthyl)propoxy]-1-ethoxy-1-[2-(2-pyrimidyloxy)propylthio]ethanol Formula: C29H40N2O4S MolecularWeight: 512.7039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)C=C(C=C2)CCCOCC(O)(OCC)SCC(C)OC3=NC=CC=N3

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)C=C(C=C2)CCCOCC(O)(OCC)SCC(C)OC3=NC=CC=N3

InChI

InChI=1S/C29H40N2O4S/c1-4-6-7-10-24-12-14-27-20-25(13-15-26(27)19-24)11-8-18-33-22-29(32,34-5-2)36-21-23(3)35-28-30-16-9-17-31-28/h9,12-17,19-20,23,32H,4-8,10-11,18,21-22H2,1-3H3