S-[(3-phenoxyphenyl)methyl] 3-[(4-chlorophenyl)amino]-2-methyl-propanethioate

Systemtic Name: S-[(3-phenoxyphenyl)methyl] 3-[(4-chlorophenyl)amino]-2-methyl-propanethioate Openeye Name: S-[(3-phenoxyphenyl)methyl] 3-(4-chloroanilino)-2-methyl-propanethioate CAS Name: 3-(4-chloroanilino)-2-methylpropanethioic acid S-[(3-phenoxyphenyl)methyl] ester IUPAC Name: S-[(3-phenoxyphenyl)methyl] 3-(4-chloroanilino)-2-methylpropanethioate Traditional Name: 3-(4-chloroanilino)-2-methyl-propanethioic acid S-(3-phenoxybenzyl) ester Formula: C23H22ClNO2S MolecularWeight: 411.94428

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=C(C=C1)Cl)C(=O)SCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(CNC1=CC=C(C=C1)Cl)C(=O)SCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C23H22ClNO2S/c1-17(15-25-20-12-10-19(24)11-13-20)23(26)28-16-18-6-5-9-22(14-18)27-21-7-3-2-4-8-21/h2-14,17,25H,15-16H2,1H3