(4-methylsulfanylphenyl)methyl 3-benzamidobutanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-benzamidobutanoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [4-(methylthio)benzyl] ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC1=CC=C(C=C1)SC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OCC1=CC=C(C=C1)SC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-14(20-19(22)16-6-4-3-5-7-16)12-18(21)23-13-15-8-10-17(24-2)11-9-15/h3-11,14H,12-13H2,1-2H3,(H,20,22)