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CAS Number: 801315-14-0
6-((3-(dimethylcarbamoyl)phenyl)sulfonyl)-4-((3-methoxyphenyl)amino)-8-methylquinoline-3-carboxamide hydrochloride

Structure

 6-((3-(dimethylcarbamoyl)phenyl)sulfonyl)-4-((3-methoxyphenyl)amino)-8-methylquinoline-3-carboxamide hydrochloride
Name: 6-((3-(dimethylcarbamoyl)phenyl)sulfonyl)-4-((3-methoxyphenyl)amino)-8-methylquinoline-3-carboxamide hydrochloride
Synonyms:
General Information
Product Number: 801315140

CAS Registry Number 801315-14-0
(Component: 801312-28-7)
Name:
3-?Quinolinecarboxamide?, 6-?[[3-?[(dimethylamino)?carbonyl]?phenyl]?sulfonyl]?-?4-?[(3-?methoxyphenyl)?amino]?-?8-?methyl-?, hydrochloride (1:1)
3-Quinolinecarboxamide, 6-[[3-[(dimethylamino)carbonyl]phenyl]sulfonyl]-4-[(3-methoxyphenyl)amino]-8-methyl-, monohydrochloride (9CI)

 

Chemical Formula: C27H27ClN4O5S
Exact Mass: 554.14
Molecular Weight: 555.05
m/z: 554.14 (100.0%), 556.14 (33.7%), 555.14 (31.7%), 557.14 (11.2%), 556.13 (4.5%), 556.15 (4.3%), 558.14 (2.1%), 558.13 (1.5%)

 

InChI:InChI=1S/C27H26N4O5S.ClH/c1-16-11-21(37(34,35)20-10-5-7-17(12-20)27(33)31(2)3)14-22-24(16)29-15-23(26(28)32)25(22)30-18-8-6-9-19(13-18)36-4;/h5-15H,1-4H3,(H2,28,32)(H,29,30);1H

InChI Key:OJXWJOXQUQXGMG-UHFFFAOYSA-N

Canonical SMILES:CC1=C2C(=CC(=C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)N(C)C)C(=C(C=N2)C(=O)N)NC4=CC(=CC=C4)OC.Cl

Specification

98%
References
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