Catalog Number:
AG006N8J
Chemical Name:
(S)-2-Amino-1-(3-methyl-4-((4-methylisoquinolin-5-yl)sulfonyl)-1,4-diazepan-1-yl)ethanone dihydrochloride
CAS Number:
913844-45-8
Molecular Formula:
C18H26Cl2N4O3S
Molecular Weight:
449.3950
MDL Number:
MFCD09971082
IUPAC Name:
2-amino-1-[(3S)-3-methyl-4-(4-methylisoquinolin-5-yl)sulfonyl-1,4-diazepan-1-yl]ethanone;dihydrochloride
InChI:
InChI=1S/C18H24N4O3S.2ClH/c1-13-10-20-11-15-5-3-6-16(18(13)15)26(24,25)22-8-4-7-21(12-14(22)2)17(23)9-19;;/h3,5-6,10-11,14H,4,7-9,12,19H2,1-2H3;2*1H/t14-;;/m0../s1
InChI Key:
ILDBNQGLZFSHQZ-UTLKBRERSA-N
SMILES:
NCC(=O)N1CCCN([C@@H](C1)C)S(=O)(=O)c1cccc2c1c(C)cnc2.Cl.Cl
