Products 1428959-93-6

CAS 1428959-93-6 is the registry number for 1-(3,5-Bis(trifluoromethyl)phenyl)-3-((1S,2S)-2-(3,5-dihydro-4H-dinaphtho[2,1-c:1',2'-e]azepin-4-yl)-1,2-diphenylethyl)urea, 95%. Offered by: Chemat Brand. Available pack sizes: on request.

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

1-[(1S,2S)-2-(13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)-1,2-diphenylethyl]-3-[3,5-bis(trifluoromethyl)phenyl]urea (CAS 1428959-93-6) is a chemical compound with the molecular formula C45H33F6N3O and a molecular weight of 745.8 g/mol. IUPAC name: 1-[(1S,2S)-2-(13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)-1,2-diphenylethyl]-3-[3,5-bis(trifluoromethyl)phenyl]urea. InChIKey: RSQIKIVTGIIDCO-COCZKOEFSA-N.

Identity
Molecular formulaC45H33F6N3O
Molecular weight745.8 g/mol
IUPAC name1-[(1S,2S)-2-(13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)-1,2-diphenylethyl]-3-[3,5-bis(trifluoromethyl)phenyl]urea
InChIKeyRSQIKIVTGIIDCO-COCZKOEFSA-N
SMILESC1C2=C(C3=CC=CC=C3C=C2)C4=C(CN1[C@@H](C5=CC=CC=C5)[C@H](C6=CC=CC=C6)NC(=O)NC7=CC(=CC(=C7)C(F)(F)F)C(F)(F)F)C=CC8=CC=CC=C84

Computed by PubChem (NCBI)