S-(4-chlorophenyl) (3S)-3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanethioate

Systemtic Name: S-(4-chlorophenyl) (3S)-3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanethioate Openeye Name: S-(4-chlorophenyl) (3S)-3-phenyl-3-(p-tolylsulfonylamino)propanethioate CAS Name: (3S)-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanethioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) (3S)-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanethioate Traditional Name: (3S)-3-phenyl-3-(tosylamino)propanethioic acid S-(4-chlorophenyl) ester Formula: C22H20ClNO3S2 MolecularWeight: 445.9821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)SC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(=O)SC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H20ClNO3S2/c1-16-7-13-20(14-8-16)29(26,27)24-21(17-5-3-2-4-6-17)15-22(25)28-19-11-9-18(23)10-12-19/h2-14,21,24H,15H2,1H3/t21-/m0/s1