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

Systemtic Name: methyl 2-[[4-[(4-tert-butylphenyl)carbonylamino]phenyl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[[4-[(4-tert-butylbenzoyl)amino]phenyl]methylsulfanyl]acetate CAS Name: 2-[[4-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl]methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[(4-tert-butylbenzoyl)amino]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[4-[(4-tert-butylbenzoyl)amino]benzyl]thio]acetic acid methyl 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)NC2=CC=C(C=C2)CSCC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CSCC(=O)OC

InChI

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