S-(2-acetamidoethyl) (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanethioate

Systemtic Name: S-(2-acetamidoethyl) (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanethioate Openeye Name: S-(2-acetamidoethyl) (2S)-4-methyl-2-(p-tolylsulfonylamino)pentanethioate CAS Name: (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanethioic acid S-(2-acetamidoethyl) ester IUPAC Name: S-(2-acetamidoethyl) (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanethioate Traditional Name: (2S)-4-methyl-2-(tosylamino)pentanethioic acid S-(2-acetamidoethyl) ester Formula: C17H26N2O4S2 MolecularWeight: 386.52934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)SCCNC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(C)C)C(=O)SCCNC(=O)C

InChI

InChI=1S/C17H26N2O4S2/c1-12(2)11-16(17(21)24-10-9-18-14(4)20)19-25(22,23)15-7-5-13(3)6-8-15/h5-8,12,16,19H,9-11H2,1-4H3,(H,18,20)/t16-/m0/s1