cyanomethyl (2R)-2-[(2,4-dichlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: cyanomethyl (2R)-2-[(2,4-dichlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: cyanomethyl (2R)-2-[(2,4-dichlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid cyanomethyl ester IUPAC Name: cyanomethyl (2R)-2-[(2,4-dichlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(2,4-dichlorobenzoyl)amino]-4-(methylthio)butyric acid cyanomethyl ester Formula: C14H14Cl2N2O3S MolecularWeight: 361.24356

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC#N)NC(=O)C1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CSCC[C@H](C(=O)OCC#N)NC(=O)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H14Cl2N2O3S/c1-22-7-4-12(14(20)21-6-5-17)18-13(19)10-3-2-9(15)8-11(10)16/h2-3,8,12H,4,6-7H2,1H3,(H,18,19)/t12-/m1/s1