Ταυτότητα

Tioconazole EP Impurity B

Δεν αναφέρεται · C16H12Cl4N2OS

01Ταυτότητα

Lazychem ID	LC-44280
CAS RN	Δεν αναφέρεται
PubChem CID	14178484
Molecular formula	C16H12Cl4N2OS
Molecular weight	422.2 g/mol
IUPAC name	1-[2-(2,4-dichlorophenyl)-2-[(2,5-dichlorothiophen-3-yl)methoxy]ethyl]imidazole
InChIKey	NDKWVRDSKYWMTA-UHFFFAOYSA-N

02Δομή και στερεοχημεία

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

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

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

SMILES	C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)OCC3=C(SC(=C3)Cl)Cl
InChI	Δεν αναφέρεται

03Stereochemistry

The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres1Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 2Before 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.