cyanomethyl (2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: cyanomethyl (2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: cyanomethyl (2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-4-(methylthio)butanoic acid cyanomethyl ester IUPAC Name: cyanomethyl (2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-4-(methylthio)butyric acid cyanomethyl ester Formula: C15H20N2O4S2 MolecularWeight: 356.4603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CCSC)C(=O)OCC#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N[C@H](CCSC)C(=O)OCC#N

InChI

InChI=1S/C15H20N2O4S2/c1-11-4-5-12(2)14(10-11)23(19,20)17-13(6-9-22-3)15(18)21-8-7-16/h4-5,10,13,17H,6,8-9H2,1-3H3/t13-/m1/s1