4-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]butanoate

Systemtic Name: 4-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]butanoate Openeye Name: 4-[[2-(2-amino-4-oxo-thiazol-5-yl)acetyl]amino]butanoate CAS Name: 4-[[2-(2-amino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]butanoate IUPAC Name: 4-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(2-amino-4-keto-2-thiazolin-5-yl)acetyl]amino]butyrate Formula: C9H12N3O4S- MolecularWeight: 258.27428

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)[O-])CNC(=O)CC1C(=O)N=C(S1)N

Isomeric SMILES

C(CC(=O)[O-])CNC(=O)CC1C(=O)N=C(S1)N

InChI

InChI=1S/C9H13N3O4S/c10-9-12-8(16)5(17-9)4-6(13)11-3-1-2-7(14)15/h5H,1-4H2,(H,11,13)(H,14,15)(H2,10,12,16)/p-1