Identité

Cefditoren Impurity 27

Non indiqué · C21H19N3O4S2

01Identité

Lazychem ID	LC-39654
CAS RN	Non indiqué
PubChem CID	58685990
Molecular formula	C21H19N3O4S2
Molecular weight	441.5 g/mol
IUPAC name	3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChIKey	DGGHKCJHKVVAKE-FPLPWBNLSA-N

02Structure et stéréochimie

Two-dimensional chemical structure of Cefditoren Impurity 27 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	4
Secondary amines	0
Tertiary amines	0

SMILES	CC1=C(SC=N1)/C=C\C2=C(N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)O
InChI	Non indiqué

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres2Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 4Before 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.