7-azanyl-8-oxidanylidene-3-[(4-pyrrolidin-1-ylcarbonyl-1,3-thiazol-5-yl)sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-8-oxidanylidene-3-[(4-pyrrolidin-1-ylcarbonyl-1,3-thiazol-5-yl)sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-8-oxo-3-[[4-(pyrrolidine-1-carbonyl)thiazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-8-oxo-3-[[[4-[oxo(1-pyrrolidinyl)methyl]-5-thiazolyl]thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-8-oxo-3-[[4-(pyrrolidine-1-carbonyl)-1,3-thiazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-8-keto-3-[[[4-(pyrrolidine-1-carbonyl)thiazol-5-yl]thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H18N4O4S3 MolecularWeight: 426.53352

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(SC=N2)SCC3=C(N4C(C(C4=O)N)SC3)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(SC=N2)SCC3=C(N4C(C(C4=O)N)SC3)C(=O)O

InChI

InChI=1S/C16H18N4O4S3/c17-9-12(21)20-11(15(23)24)8(5-25-14(9)20)6-26-16-10(18-7-27-16)13(22)19-3-1-2-4-19/h7,9,14H,1-6,17H2,(H,23,24)