(2S)-5-azanyl-5-oxidanylidene-2-(4-thiophen-2-ylbutanoylamino)pentanoate

Systemtic Name: (2S)-5-azanyl-5-oxidanylidene-2-(4-thiophen-2-ylbutanoylamino)pentanoate Openeye Name: (2S)-5-amino-5-oxo-2-[4-(2-thienyl)butanoylamino]pentanoate CAS Name: (2S)-5-amino-5-oxo-2-[(1-oxo-4-thiophen-2-ylbutyl)amino]pentanoate IUPAC Name: (2S)-5-amino-5-oxo-2-(4-thiophen-2-ylbutanoylamino)pentanoate Traditional Name: (2S)-5-amino-5-keto-2-[4-(2-thienyl)butanoylamino]valerate Formula: C13H17N2O4S- MolecularWeight: 297.35008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4S/c14-11(16)7-6-10(13(18)19)15-12(17)5-1-3-9-4-2-8-20-9/h2,4,8,10H,1,3,5-7H2,(H2,14,16)(H,15,17)(H,18,19)/p-1/t10-/m0/s1