Products 901128-79-8

CAS 901128-79-8 is the registry number for CEP-11981 (tosylate). Offered by: MedChemExpress. Available pack sizes: Get quote.

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

4-methylbenzenesulfonic acid;19-methyl-3-(2-methylpropyl)-7-(pyrimidin-2-ylamino)-3,13,19,20-tetrazahexacyclo[14.7.0.02,10.04,9.011,15.017,21]tricosa-1(16),2(10),4(9),5,7,11(15),17,20-octaen-14-one (CAS 901128-79-8) is a chemical compound with the molecular formula C35H35N7O4S and a molecular weight of 649.8 g/mol. IUPAC name: 4-methylbenzenesulfonic acid;19-methyl-3-(2-methylpropyl)-7-(pyrimidin-2-ylamino)-3,13,19,20-tetrazahexacyclo[14.7.0.02,10.04,9.011,15.017,21]tricosa-1(16),2(10),4(9),5,7,11(15),17,20-octaen-14-one. InChIKey: OCCDXAYTEKPNMM-UHFFFAOYSA-N.

Identity
Molecular formulaC35H35N7O4S
Molecular weight649.8 g/mol
IUPAC name4-methylbenzenesulfonic acid;19-methyl-3-(2-methylpropyl)-7-(pyrimidin-2-ylamino)-3,13,19,20-tetrazahexacyclo[14.7.0.02,10.04,9.011,15.017,21]tricosa-1(16),2(10),4(9),5,7,11(15),17,20-octaen-14-one
InChIKeyOCCDXAYTEKPNMM-UHFFFAOYSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)O.CC(C)CN1C2=C(C=C(C=C2)NC3=NC=CC=N3)C4=C1C5=C(C6=CN(N=C6CC5)C)C7=C4CNC7=O

Computed by PubChem (NCBI)

Synonyms: orb2566644