1,4-DIMETHYL-5-[(2-PHENYL-1H-INDOL-3-YL)AZO]-1H-1,2,4-TRIAZOLIUM METHYL SULPHATE

CAS No.
52435-12-8
CCD No.
CCD06667925
Formula
C19 H17 N5 . C H4 O4 S
MolWeight
427.483

Basic Information

Product Name: 1,4-DIMETHYL-5-[(2-PHENYL-1H-INDOL-3-YL)AZO]-1H-1,2,4-TRIAZOLIUM METHYL SULPHATE
CAS: 52435-12-8
English Synonyms: 1,4-DIMETHYL-5-[(2-PHENYL-1H-INDOL-3-YL)AZO]-1H-1,2,4-TRIAZOLIUM METHYL SULPHATE
MDL Number.: MFCD21609204
H bond acceptor: 5
H bond donor: 1
Smile: Cc1c(n(cn1)C)/N=N/c2c3ccccc3[nH]c2c4ccccc4.COS(=O)(=O)O
InChi: InChI=1S/C19H17N5.CH4O4S/c1-13-19(24(2)12-20-13)23-22-18-15-10-6-7-11-16(15)21-17(18)14-8-4-3-5-9-14;1-5-6(2,3)4/h3-12,21H,1-2H3;1H3,(H,2,3,4)/b23-22+;
InChiKey: InChIKey=ZMXQQXNUNRDTQB-PGCQSHBKSA-N

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