Vitas-M small molecule compound

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

Catalog ID
STL008783
SMILES OCCOCCNC(=O)[C@@H](NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)Cc1ccccc1

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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 C26H29N3O7 MW 495.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O7/c1-2-29-15-19(24(31)18-13-22-23(14-21(18)29)36-16-35-22)25(32)28-20(12-17-6-4-3-5-7-17)26(33)27-8-10-34-11-9-30/h3-7,13-15,20,30H,2,8-12,16H2,1H3,(H,27,33)(H,28,32)/t20-/m0/s1
InChIKey
HFAKRTYKDWEMQG-FQEVSTJZSA-N
Synonyms
1014106-16-1
(S)5ethylN(1((2(2hydroxyethoxy)ethyl)amino)1oxo3phenylpropan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
1014106161
5ethylN((2S)1((2(2hydroxyethoxy)ethyl)amino)1oxo3phenylpropan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1(2(2hydroxyethoxy)ethylamino)1oxo3phenylpropan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CC4=CC=CC=C4)C(=O)NCCOCCO
InChI=1SC26H29N3O7c12291519(24(31)18132223(1421(18)29)36163522)25(32)2820(12176435717)26(33)278103411930h3713152030H281216H21H3(H2733)(H2832)t20m0s1
OCCOCCNC(=O)(C@@H)(NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)Cc1ccccc1
ZINC000013624741
ZINC13624741

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Available files

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