S-phenethyl 2-(2-methoxy-4-methyl-phenyl)ethanethioate

Systemtic Name: S-phenethyl 2-(2-methoxy-4-methyl-phenyl)ethanethioate Openeye Name: S-phenethyl 2-(2-methoxy-4-methyl-phenyl)ethanethioate CAS Name: 2-(2-methoxy-4-methylphenyl)ethanethioic acid S-phenethyl ester IUPAC Name: S-phenethyl 2-(2-methoxy-4-methylphenyl)ethanethioate Traditional Name: 2-(2-methoxy-4-methyl-phenyl)ethanethioic acid S-phenethyl ester Formula: C18H20O2S MolecularWeight: 300.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(=O)SCCC2=CC=CC=C2)OC

Isomeric SMILES

CC1=CC(=C(C=C1)CC(=O)SCCC2=CC=CC=C2)OC

InChI

InChI=1S/C18H20O2S/c1-14-8-9-16(17(12-14)20-2)13-18(19)21-11-10-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3