Vitas-M small molecule compound
methyl 5-chloro-3-({[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STL526862
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c([C@@H]1C)cc(c(c3)O)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 C23H24ClN3O5 MW 457.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN3O5/c1-12-15-10-19(31-2)18(28)8-13(15)6-7-27(12)11-20(29)26-21-16-9-14(24)4-5-17(16)25-22(21)23(30)32-3/h4-5,8-10,12,25,28H,6-7,11H2,1-3H3,(H,26,29)/t12-/m0/s1InChIKey
JVDMOXGTGOARJW-LBPRGKRZSA-NSynonyms
(R)methyl5chloro3(2(6hydroxy7methoxy1methyl34dihydroisoquinolin2(1H)yl)acetamido)1Hindole2carboxylatehydrochloride
6348340
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCc3c((C@H)1C)cc(c(c3)O)OC)cc(cc2)ClCl
InChI=1SC23H24ClN3O5c112151019(312)18(28)813(15)6727(12)1120(29)262116914(24)4517(16)2522(21)23(30)323h45810122528H6711H213H3(H2629)t12m0s1
methyl5chloro3((((1S)6hydroxy7methoxy1methyl34dihydroisoquinolin2(1H)yl)acetyl)amino)1Hindole2carboxylate
methyl5chloro3((2((1~(S))6hydroxy7methoxy1methyl34dihydro1~(H)isoquinolin2yl)acetyl)amino)1~(H)indole2carboxylate
METHYL5CHLORO3((2((1S)6HYDROXY7METHOXY1METHYL34DIHYDRO1HISOQUINOLIN2YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
MFCD03006314
ZINC000016041559
ZINC16041559
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