2-[3-(6-pentylnaphthalen-2-yl)-1-propoxy-1-[2-(2-pyridin-1-ium-1-ylethoxy)ethylsulfinyl]propan-2-yl]oxypyrimidine

Systemtic Name: 2-[3-(6-pentylnaphthalen-2-yl)-1-propoxy-1-[2-(2-pyridin-1-ium-1-ylethoxy)ethylsulfinyl]propan-2-yl]oxypyrimidine Openeye Name: 2-[1-[(6-pentyl-2-naphthyl)methyl]-2-propoxy-2-[2-(2-pyridin-1-ium-1-ylethoxy)ethylsulfinyl]ethoxy]pyrimidine CAS Name: 2-[3-(6-pentyl-2-naphthalenyl)-1-propoxy-1-[2-[2-(1-pyridin-1-iumyl)ethoxy]ethylsulfinyl]propan-2-yl]oxypyrimidine IUPAC Name: 2-[3-(6-pentylnaphthalen-2-yl)-1-propoxy-1-[2-(2-pyridin-1-ium-1-ylethoxy)ethylsulfinyl]propan-2-yl]oxypyrimidine Traditional Name: 2-[1-[(6-amyl-2-naphthyl)methyl]-2-propoxy-2-[2-(2-pyridin-1-ium-1-ylethoxy)ethylsulfinyl]ethoxy]pyrimidine Formula: C34H44N3O4S+ MolecularWeight: 590.79586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)C=C(C=C2)CC(C(OCCC)S(=O)CCOCC[N+]3=CC=CC=C3)OC4=NC=CC=N4

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)C=C(C=C2)CC(C(OCCC)S(=O)CCOCC[N+]3=CC=CC=C3)OC4=NC=CC=N4

InChI

InChI=1S/C34H44N3O4S/c1-3-5-7-11-28-12-14-31-26-29(13-15-30(31)25-28)27-32(41-34-35-16-10-17-36-34)33(40-21-4-2)42(38)24-23-39-22-20-37-18-8-6-9-19-37/h6,8-10,12-19,25-26,32-33H,3-5,7,11,20-24,27H2,1-2H3/q+1