(4-methylsulfanylphenyl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-[(4-tert-butylbenzoyl)amino]acetate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-[(4-tert-butylbenzoyl)amino]acetate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]acetic acid [4-(methylthio)benzyl] ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C21H25NO3S/c1-21(2,3)17-9-7-16(8-10-17)20(24)22-13-19(23)25-14-15-5-11-18(26-4)12-6-15/h5-12H,13-14H2,1-4H3,(H,22,24)