6-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-6-ylsulfanyl)-6-(2-hydroxyethyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-6-ylsulfanyl)-6-(2-hydroxyethyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-6-ylsulfanyl)-6-(2-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-6-ylthio)-6-(2-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-6-ylsulfanyl)-6-(2-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(6,7-dihydro-5H-pyrrol[1,2-c]imidazol-6-ylthio)-6-(2-hydroxyethyl)-7-keto-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(N2C1C(C2=O)(CCO)SC3CC4=CN=CN4C3)C(=O)O

Isomeric SMILES

CC1C=C(N2C1C(C2=O)(CCO)SC3CC4=CN=CN4C3)C(=O)O

InChI

InChI=1S/C16H19N3O4S/c1-9-4-12(14(21)22)19-13(9)16(2-3-20,15(19)23)24-11-5-10-6-17-8-18(10)7-11/h4,6,8-9,11,13,20H,2-3,5,7H2,1H3,(H,21,22)