ethyl 3-[4-(2-diethylaminoethyloxy)phenyl]-2-(4-ethoxyphenyl)sulfanyl-2-methyl-propanoate

Systemtic Name: ethyl 3-[4-(2-diethylaminoethyloxy)phenyl]-2-(4-ethoxyphenyl)sulfanyl-2-methyl-propanoate Openeye Name: ethyl 3-[4-(2-diethylaminoethyloxy)phenyl]-2-(4-ethoxyphenyl)sulfanyl-2-methyl-propanoate CAS Name: 3-[4-(2-diethylaminoethyloxy)phenyl]-2-[(4-ethoxyphenyl)thio]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(2-diethylaminoethyloxy)phenyl]-2-(4-ethoxyphenyl)sulfanyl-2-methylpropanoate Traditional Name: 3-[4-(2-diethylaminoethyloxy)phenyl]-2-methyl-2-(p-phenetylthio)propionic acid ethyl ester Formula: C26H37NO4S MolecularWeight: 459.64128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)CC(C)(C(=O)OCC)SC2=CC=C(C=C2)OCC

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)CC(C)(C(=O)OCC)SC2=CC=C(C=C2)OCC

InChI

InChI=1S/C26H37NO4S/c1-6-27(7-2)18-19-31-23-12-10-21(11-13-23)20-26(5,25(28)30-9-4)32-24-16-14-22(15-17-24)29-8-3/h10-17H,6-9,18-20H2,1-5H3