(2S)-2-[[(E)-but-2-enoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[(E)-but-2-enoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[(E)-but-2-enoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-4-(methylthio)-2-[[(E)-1-oxobut-2-enyl]amino]butanoate IUPAC Name: (2S)-2-[[(E)-but-2-enoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(E)-but-2-enoyl]amino]-4-(methylthio)butyrate Formula: C9H14NO3S- MolecularWeight: 216.27736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

C/C=C/C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C9H15NO3S/c1-3-4-8(11)10-7(9(12)13)5-6-14-2/h3-4,7H,5-6H2,1-2H3,(H,10,11)(H,12,13)/p-1/b4-3+/t7-/m0/s1