Vitas-M small molecule compound
ethyl 3-{[(3-chlorotricyclo[3.3.1.1~3,7~]dec-1-yl)carbonyl]amino}-5-methyl-1H-indole-2-carboxylate
Catalog ID
STL338881
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)C13CC4CC(C1)CC(C3)(C4)Cl)cc(cc2)C
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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 C23H27ClN2O3 MW 414.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN2O3/c1-3-29-20(27)19-18(16-6-13(2)4-5-17(16)25-19)26-21(28)22-8-14-7-15(9-22)11-23(24,10-14)12-22/h4-6,14-15,25H,3,7-12H2,1-2H3,(H,26,28)InChIKey
NEMDWVAFHRGICR-UHFFFAOYSA-NSynonyms
893790-97-1893790971
CCOC(=O)c1(nH)c2c(c1NC(=O)C13CC4CC(C1)CC(C3)(C4)Cl)cc(cc2)C
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl
ethyl3(((3chlorotricyclo(3311~37~)dec1yl)carbonyl)amino)5methyl1Hindole2carboxylate
ethyl3((1r3s5R7S)3chloroadamantane1carboxamido)5methyl1Hindole2carboxylate
ETHYL3((3CHLOROADAMANTANE1CARBONYL)AMINO)5METHYL1HINDOLE2CARBOXYLATE
InChI=1SC23H27ClN2O3c132920(27)1918(16613(2)4517(16)2519)2621(28)22814715(922)1123(241014)1222h46141525H3712H212H3(H2628)
ZINC000101031914
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