Identidad

Dimethyl acetildenafil

No indicado · C25H34N6O3

01Identidad

Lazychem ID	LC-34819
CAS RN	No indicado
PubChem CID	135564638
Molecular formula	C25H34N6O3
Molecular weight	466.6 g/mol
IUPAC name	5-[5-[2-[(3R,5S)-3,5-dimethylpiperazin-1-yl]acetyl]-2-ethoxyphenyl]-1-methyl-3-propyl-6H-pyrazolo[4,5-d]pyrimidin-7-one
InChIKey	YMCRGTBWSIWENP-IYBDPMFKSA-N

02Estructura y estereoquímica

Two-dimensional chemical structure of Dimethyl acetildenafil — 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, has 2 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	2
Ring count	4
Secondary amines	1
Tertiary amines	1

SMILES	CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)C(=O)CN4C[C@H](N[C@H](C4)C)C)OCC)C
InChI	No indicado

03Stereochemistry

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

Defined centres2Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

2 records

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.