Vitas-M small molecule compound
2-(methylsulfanyl)ethyl 6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK405533
SMILES CSCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(c(c1)OC)OC
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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 C21H25NO5S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO5S/c1-12-19-15(22-20(12)21(24)27-7-8-28-4)9-14(10-16(19)23)13-5-6-17(25-2)18(11-13)26-3/h5-6,11,14,22H,7-10H2,1-4H3InChIKey
AWWATMYXUMJZIX-UHFFFAOYSA-NSynonyms
2(methylsulfanyl)ethyl6(34dimethoxyphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
2methylsulfanylethyl6(34dimethoxyphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
2METHYLTHIOETHYL6(34DIMETHOXYPHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
CC1=C(NC2=C1C(=O)CC(C2)C3=CC(=C(C=C3)OC)OC)C(=O)OCCSC
CSCCOC(=O)c1(nH)c2c(c1C)C(=O)CC(C2)c1ccc(c(c1)OC)OC
InChI=1SC21H25NO5Sc1121915(2220(12)21(24)2778284)914(1016(19)23)135617(252)18(1113)263h56111422H710H214H3
MFCD06754223
ZINC000004911524
ZINC000004911528
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