methyl 2-[4-[3-[ethyl-(5-phenylpyridin-2-yl)amino]propylsulfanyl]-5-methoxy-2-methyl-phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[3-[ethyl-(5-phenylpyridin-2-yl)amino]propylsulfanyl]-5-methoxy-2-methyl-phenoxy]ethanoate Openeye Name: methyl 2-[4-[3-[ethyl-(5-phenyl-2-pyridyl)amino]propylsulfanyl]-5-methoxy-2-methyl-phenoxy]acetate CAS Name: 2-[4-[3-[ethyl-(5-phenyl-2-pyridinyl)amino]propylthio]-5-methoxy-2-methylphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[3-[ethyl-(5-phenylpyridin-2-yl)amino]propylsulfanyl]-5-methoxy-2-methylphenoxy]acetate Traditional Name: 2-[4-[3-[ethyl-(5-phenyl-2-pyridyl)amino]propylthio]-5-methoxy-2-methyl-phenoxy]acetic acid methyl ester Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCSC1=C(C=C(C(=C1)C)OCC(=O)OC)OC)C2=NC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CCCSC1=C(C=C(C(=C1)C)OCC(=O)OC)OC)C2=NC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O4S/c1-5-29(26-13-12-22(18-28-26)21-10-7-6-8-11-21)14-9-15-34-25-16-20(2)23(17-24(25)31-3)33-19-27(30)32-4/h6-8,10-13,16-18H,5,9,14-15,19H2,1-4H3