Products 2411004-22-1

CAS 2411004-22-1 appears in our catalog under these names: Inupadenant hydrochloride, Inupadenant HCl, Inupadenant (hydrochloride), 99.60%, Inupadenant (hydrochloride), 99%. Offered by: GLPBio, TargetMol, MedChemExpress, Chemat. Available pack sizes: 1mg, 25mg, 50mg, 100mg, 25 mg, 50 mg, 10 mg, 5 mg.

Structural formula: {0} (CAS {1})

7-amino-10-[2-[4-[2,4-difluoro-5-[2-[(S)-methylsulfinyl]ethoxy]phenyl]piperazin-1-yl]ethyl]-4-(furan-2-yl)-12-thia-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7-tetraen-11-one;hydrochloride (CAS 2411004-22-1) is a chemical compound with the molecular formula C25H27ClF2N8O4S2 and a molecular weight of 641.1 g/mol. IUPAC name: 7-amino-10-[2-[4-[2,4-difluoro-5-[2-[(S)-methylsulfinyl]ethoxy]phenyl]piperazin-1-yl]ethyl]-4-(furan-2-yl)-12-thia-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7-tetraen-11-one;hydrochloride. InChIKey: DDVRGKDOXQCEQN-YZNDQDBRSA-N.

Identity
Molecular formulaC25H27ClF2N8O4S2
Molecular weight641.1 g/mol
IUPAC name7-amino-10-[2-[4-[2,4-difluoro-5-[2-[(S)-methylsulfinyl]ethoxy]phenyl]piperazin-1-yl]ethyl]-4-(furan-2-yl)-12-thia-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7-tetraen-11-one;hydrochloride
InChIKeyDDVRGKDOXQCEQN-YZNDQDBRSA-N
SMILESC[S@](=O)CCOC1=C(C=C(C(=C1)N2CCN(CC2)CCN3C4=C(C5=NC(=NN5C(=N4)N)C6=CC=CO6)SC3=O)F)F.Cl

Computed by PubChem (NCBI)