Products 2649799-31-3

CAS 2649799-31-3 appears in our catalog under these names: Lumateperone Impurity 6, Lumateperone Impurity 16. Offered by: Chemat Brand. Available pack sizes: on request.

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

4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]-1-[4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]phenyl]butan-1-one (CAS 2649799-31-3) is a chemical compound with the molecular formula C38H46N6O and a molecular weight of 602.8 g/mol. IUPAC name: 4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]-1-[4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]phenyl]butan-1-one. InChIKey: LYTKNFUECCMLNS-YRCZKMHPSA-N.

Identity
Molecular formulaC38H46N6O
Molecular weight602.8 g/mol
IUPAC name4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]-1-[4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]phenyl]butan-1-one
InChIKeyLYTKNFUECCMLNS-YRCZKMHPSA-N
SMILESCN1CCN2[C@H]3CCN(C[C@H]3C4=C2C1=CC=C4)CCCC(=O)C5=CC=C(C=C5)N6CC[C@H]7[C@@H](C6)C8=C9N7CCN(C9=CC=C8)C

Computed by PubChem (NCBI)