Vitas-M small molecule compound
3-methoxy-3-methylbutan-2-yl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK405483
SMILES COC(C(OC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C)C)(C)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 C26H35NO4 MW 425.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35NO4/c1-15-22-20(27-23(15)24(29)31-16(2)26(6,7)30-8)13-18(14-21(22)28)17-9-11-19(12-10-17)25(3,4)5/h9-12,16,18,27H,13-14H2,1-8H3InChIKey
MUICXTJRJWBWTP-UHFFFAOYSA-NSynonyms
(3methoxy3methylbutan2yl)6(4tertbutylphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
2METHOXY12DIMETHYLPROPYL6(4(TERTBUTYL)PHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
3methoxy3methylbutan2yl6(4tertbutylphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
CC1=C(NC2=C1C(=O)CC(C2)C3=CC=C(C=C3)C(C)(C)C)C(=O)OC(C)C(C)(C)OC
COC(C(OC(=O)c1(nH)c2c(c1C)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C)C)(C)C
InChI=1SC26H35NO4c1152220(2723(15)24(29)3116(2)26(67)308)1318(1421(22)28)1791119(121017)25(34)5h912161827H1314H218H3
MFCD06754180
ZINC000004911216
ZINC000004911228
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