Vitas-M small molecule compound

methyl 5-chloro-3-({[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]acetyl}amino)-1H-indole-2-carboxylate

Catalog ID
STL526868
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c([C@@H]1C)cc(c(c3)OC)OC)cc(cc2)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H26ClN3O5 MW 471.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN3O5/c1-13-16-11-20(32-3)19(31-2)9-14(16)7-8-28(13)12-21(29)27-22-17-10-15(25)5-6-18(17)26-23(22)24(30)33-4/h5-6,9-11,13,26H,7-8,12H2,1-4H3,(H,27,29)/t13-/m0/s1
InChIKey
JNWCNXRSZJBSPY-ZDUSSCGKSA-N
Synonyms
450369-49-0
(S)methyl5chloro3(2(67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)acetamido)1Hindole2carboxylate
16397440
450369490
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCc3c((C@@H)1C)cc(c(c3)OC)OC)cc(cc2)Cl
InChI=1SC24H26ClN3O5c113161120(323)19(312)914(16)7828(13)1221(29)2722171015(25)5618(17)2623(22)24(30)334h569111326H7812H214H3(H2729)t13m0s1
methyl5chloro3((((1S)67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)acetyl)amino)1Hindole2carboxylate
methyl5chloro3((2((1~(S))67dimethoxy1methyl34dihydro1~(H)isoquinolin2yl)acetyl)amino)1~(H)indole2carboxylate
MFCD03005982
ZINC000012660555
ZINC12660555

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Available files

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