3-(1-azanyl-5-ethylsulfanyl-pentyl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(1-azanyl-5-ethylsulfanyl-pentyl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(1-amino-5-ethylsulfanyl-pentyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-[1-amino-5-(ethylthio)pentyl]-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(1-amino-5-ethylsulfanylpentyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-[1-amino-5-(ethylthio)pentyl]-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C15H24N2O4S2 MolecularWeight: 360.49206

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCCCC(C1=C(N2C(S1)C(C2=O)C(C)O)C(=O)O)N

Isomeric SMILES

CCSCCCCC(C1=C(N2C(S1)C(C2=O)C(C)O)C(=O)O)N

InChI

InChI=1S/C15H24N2O4S2/c1-3-22-7-5-4-6-9(16)12-11(15(20)21)17-13(19)10(8(2)18)14(17)23-12/h8-10,14,18H,3-7,16H2,1-2H3,(H,20,21)