[4-[2-[[4-(4-methoxyphenyl)-2-methyl-butan-2-yl]amino]ethanoyl]-2-methylsulfanyl-phenyl] ethanoate

Systemtic Name: [4-[2-[[4-(4-methoxyphenyl)-2-methyl-butan-2-yl]amino]ethanoyl]-2-methylsulfanyl-phenyl] ethanoate Openeye Name: [4-[2-[[3-(4-methoxyphenyl)-1,1-dimethyl-propyl]amino]acetyl]-2-methylsulfanyl-phenyl] acetate CAS Name: acetic acid [4-[2-[[4-(4-methoxyphenyl)-2-methylbutan-2-yl]amino]-1-oxoethyl]-2-(methylthio)phenyl] ester IUPAC Name: [4-[2-[[4-(4-methoxyphenyl)-2-methylbutan-2-yl]amino]acetyl]-2-methylsulfanylphenyl] acetate Traditional Name: acetic acid [4-[2-[[3-(4-methoxyphenyl)-1,1-dimethyl-propyl]amino]acetyl]-2-(methylthio)phenyl] ester Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)CCC2=CC=C(C=C2)OC)SC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)CCC2=CC=C(C=C2)OC)SC

InChI

InChI=1S/C23H29NO4S/c1-16(25)28-21-11-8-18(14-22(21)29-5)20(26)15-24-23(2,3)13-12-17-6-9-19(27-4)10-7-17/h6-11,14,24H,12-13,15H2,1-5H3