Identitet

Tazobactam Impurity A

Ikke angivet · C23H22N4O4S

01Identitet

Lazychem ID	LC-33167
CAS RN	Ikke angivet
PubChem CID	168009300
Molecular formula	C23H22N4O4S
Molecular weight	450.5 g/mol
IUPAC name	benzhydryl (2S,3S,5R)-3-methyl-4,7-dioxo-3-(triazol-1-ylmethyl)-4lambda4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
InChIKey	VPSDLKPEYQXADA-USBFVBQESA-N

02Struktur og stereokemi

Two-dimensional chemical structure of Tazobactam Impurity A — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon, has 3 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	3
Ring count	5
Secondary amines	0
Tertiary amines	0

SMILES	C[C@@]1([C@@H](N2[C@H](S1=O)CC2=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)CN5C=CN=N5
InChI	Ikke angivet

03Stereochemistry

The published structure contains 3 defined and 1 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres3Structure assigned

Unassigned centres1Structure unspecified

Assignment statusPartially assignedExact published identity

Tetrahedral upper bound≤ 16Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.