(2S)-4-azanyl-4-oxidanylidene-2-(4-thiophen-2-ylbutanoylamino)butanoate

Systemtic Name: (2S)-4-azanyl-4-oxidanylidene-2-(4-thiophen-2-ylbutanoylamino)butanoate Openeye Name: (2S)-4-amino-4-oxo-2-[4-(2-thienyl)butanoylamino]butanoate CAS Name: (2S)-4-amino-4-oxo-2-[(1-oxo-4-thiophen-2-ylbutyl)amino]butanoate IUPAC Name: (2S)-4-amino-4-oxo-2-(4-thiophen-2-ylbutanoylamino)butanoate Traditional Name: (2S)-4-amino-4-keto-2-[4-(2-thienyl)butanoylamino]butyrate Formula: C12H15N2O4S- MolecularWeight: 283.3235

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCC(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CCCC(=O)N[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C12H16N2O4S/c13-10(15)7-9(12(17)18)14-11(16)5-1-3-8-4-2-6-19-8/h2,4,6,9H,1,3,5,7H2,(H2,13,15)(H,14,16)(H,17,18)/p-1/t9-/m0/s1