[4-[2-[[5-(4-methoxyphenyl)-2-methyl-pentan-2-yl]amino]ethanoyl]-2-methylsulfanyl-phenyl] ethanoate

Systemtic Name: [4-[2-[[5-(4-methoxyphenyl)-2-methyl-pentan-2-yl]amino]ethanoyl]-2-methylsulfanyl-phenyl] ethanoate Openeye Name: [4-[2-[[4-(4-methoxyphenyl)-1,1-dimethyl-butyl]amino]acetyl]-2-methylsulfanyl-phenyl] acetate CAS Name: acetic acid [4-[2-[[5-(4-methoxyphenyl)-2-methylpentan-2-yl]amino]-1-oxoethyl]-2-(methylthio)phenyl] ester IUPAC Name: [4-[2-[[5-(4-methoxyphenyl)-2-methylpentan-2-yl]amino]acetyl]-2-methylsulfanylphenyl] acetate Traditional Name: acetic acid [4-[2-[[4-(4-methoxyphenyl)-1,1-dimethyl-butyl]amino]acetyl]-2-(methylthio)phenyl] ester Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)CCCC2=CC=C(C=C2)OC)SC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)CCCC2=CC=C(C=C2)OC)SC

InChI

InChI=1S/C24H31NO4S/c1-17(26)29-22-13-10-19(15-23(22)30-5)21(27)16-25-24(2,3)14-6-7-18-8-11-20(28-4)12-9-18/h8-13,15,25H,6-7,14,16H2,1-5H3