Vitas-M small molecule compound

5-ethyl-N-[(2S)-1-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-1-oxopropan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

Catalog ID
STL533962
SMILES COc1ccc2c(c1)c(CCNC(=O)[C@@H](NC(=O)c1cn(CC)c3c(c1=O)cc1c(c3)OCO1)C)c[nH]2

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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 C27H28N4O6 MW 504.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O6/c1-4-31-13-20(25(32)19-10-23-24(11-22(19)31)37-14-36-23)27(34)30-15(2)26(33)28-8-7-16-12-29-21-6-5-17(35-3)9-18(16)21/h5-6,9-13,15,29H,4,7-8,14H2,1-3H3,(H,28,33)(H,30,34)/t15-/m0/s1
InChIKey
LWLWOPFPFOUBQB-HNNXBMFYSA-N
Synonyms
956967-05-8
(S)5ethylN(1((2(5methoxy1Hindol3yl)ethyl)amino)1oxopropan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
16408011
5ethyl~(N)((2~(S))1(2(5methoxy1~(H)indol3yl)ethylamino)1oxopropan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1((2(5methoxy1Hindol3yl)ethyl)amino)1oxopropan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
956967058
COc1ccc2c(c1)c(CCNC(=O)(C@@H)(NC(=O)c1cn(CC)c3c(c1=O)cc1c(c3)OCO1)C)c(nH)2
InChI=1SC27H28N4O6c14311320(25(32)19102324(1122(19)31)37143623)27(34)3015(2)26(33)2887161229216517(353)918(16)21h569131529H47814H213H3(H2833)(H3034)t15m0s1
ZINC000012893278
ZINC12893278

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Available files

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