Vitas-M small molecule compound
ethyl (1S)-2-{[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate
Catalog ID
STL545979
SMILES CCOC(=O)[C@@]1(C)N(CCc2c1[nH]c1c2cccc1)C(=O)N[C@H](C(=O)OC)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 C22H29N3O5 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O5/c1-6-30-20(27)22(4)18-15(14-9-7-8-10-16(14)23-18)11-12-25(22)21(28)24-17(13(2)3)19(26)29-5/h7-10,13,17,23H,6,11-12H2,1-5H3,(H,24,28)/t17-,22-/m0/s1InChIKey
NWEDVUIFUWYRJU-JTSKRJEESA-NSynonyms
956807-60-6(S)ethyl2(((S)1methoxy3methyl1oxobutan2yl)carbamoyl)1methyl2349tetrahydro1Hpyrido(34b)indole1carboxylate
7088091
956807606
CCOC(=O)(C@@)1(C)N(CCc2c1(nH)c1c2cccc1)C(=O)N(C@H)(C(=O)OC)C(C)C
ethyl(1~(S))2(((2~(S))1methoxy3methyl1oxobutan2yl)carbamoyl)1methyl49dihydro3~(H)pyrido(34b)indole1carboxylate
ethyl(1S)2(((2S)1methoxy3methyl1oxobutan2yl)carbamoyl)1methyl2349tetrahydro1Hbetacarboline1carboxylate
ETHYL(1S)2(((2S)1METHOXY3METHYL1OXOBUTAN2YL)CARBAMOYL)1METHYL49DIHYDRO3HPYRIDO(34B)INDOLE1CARBOXYLATE
InChI=1SC22H29N3O5c163020(27)22(4)1815(149781016(14)2318)111225(22)21(28)2417(13(2)3)19(26)295h710131723H61112H215H3(H2428)t1722m0s1
MFCD04145744
ZINC000004064227
ZINC4064227
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