4-oxidanylidene-4-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]butanoate Openeye Name: 4-oxo-4-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]butanoate CAS Name: 4-oxo-4-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]amino]butanoate IUPAC Name: 4-oxo-4-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]butanoate Traditional Name: 4-keto-4-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]amino]butyrate Formula: C9H12N3O3S2- MolecularWeight: 274.33988

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C9H13N3O3S2/c1-2-5-16-9-12-11-8(17-9)10-6(13)3-4-7(14)15/h2-5H2,1H3,(H,14,15)(H,10,11,13)/p-1