(2S)-4-azanyl-4-oxidanylidene-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoate

Systemtic Name: (2S)-4-azanyl-4-oxidanylidene-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoate Openeye Name: (2S)-4-amino-4-oxo-2-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]butanoate CAS Name: (2S)-4-amino-4-oxo-2-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]butanoate IUPAC Name: (2S)-4-amino-4-oxo-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoate Traditional Name: (2S)-4-amino-4-keto-2-[[(E)-3-(2-thienyl)acryloyl]amino]butyrate Formula: C11H11N2O4S- MolecularWeight: 267.28104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O4S/c12-9(14)6-8(11(16)17)13-10(15)4-3-7-2-1-5-18-7/h1-5,8H,6H2,(H2,12,14)(H,13,15)(H,16,17)/p-1/b4-3+/t8-/m0/s1