Vitas-M small molecule compound

3-{(5Z)-5-[(1-ethyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid

Catalog ID
STK953166
SMILES CCN1CCCc2c1ccc(c2)/C=C/1\SC(=S)N(C1=O)CCC(=O)O

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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 C18H20N2O3S2 MW 376.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O3S2/c1-2-19-8-3-4-13-10-12(5-6-14(13)19)11-15-17(23)20(18(24)25-15)9-7-16(21)22/h5-6,10-11H,2-4,7-9H2,1H3,(H,21,22)/b15-11-
InChIKey
LMTDUEQZFLDNHY-PTNGSMBKSA-N
Synonyms
924838-93-7
3((5Z)5((1ethyl1234tetrahydroquinolin6yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((1ethyl34dihydro2Hquinolin6yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoicacid
924838937
CCN1CCCC2=C1C=CC(=C2)C=C3C(=O)N(C(=S)S3)CCC(=O)O
CCN1CCCc2c1ccc(c2)C=C1SC(=S)N(C1=O)CCC(=O)O
InChI=1SC18H20N2O3S2c1219834131012(5614(13)19)111517(23)20(18(24)2515)9716(21)22h561011H2479H21H3(H2122)b1511
MFCD09759973
ZINC000011615984
ZINC11615984

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Available files

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