cyanomethyl (2S)-4-methylsulfanyl-2-(pent-4-enoylamino)butanoate

Systemtic Name: cyanomethyl (2S)-4-methylsulfanyl-2-(pent-4-enoylamino)butanoate Openeye Name: cyanomethyl (2S)-4-methylsulfanyl-2-(pent-4-enoylamino)butanoate CAS Name: (2S)-4-(methylthio)-2-(1-oxopent-4-enylamino)butanoic acid cyanomethyl ester IUPAC Name: cyanomethyl (2S)-4-methylsulfanyl-2-(pent-4-enoylamino)butanoate Traditional Name: (2S)-4-(methylthio)-2-(pent-4-enoylamino)butyric acid cyanomethyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC#N)NC(=O)CCC=C

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O3S/c1-3-4-5-11(15)14-10(6-9-18-2)12(16)17-8-7-13/h3,10H,1,4-6,8-9H2,2H3,(H,14,15)/t10-/m0/s1