Vitas-M small molecule compound

7,7-dimethyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione

Catalog ID
STK778145
SMILES C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccs1

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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 C20H21N3O2S3 MW 431.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S3/c1-4-7-27-19-22-21-18(28-19)23-13-10-20(2,3)11-14(24)17(13)12(9-16(23)25)15-6-5-8-26-15/h4-6,8,12H,1,7,9-11H2,2-3H3
InChIKey
RMTQCMXQADRKFZ-UHFFFAOYSA-N
Synonyms

77dimethyl1(5(prop2en1ylsulfanyl)134thiadiazol2yl)4(thiophen2yl)4678tetrahydroquinoline25(1H3H)dione
77dimethyl1(5prop2enylsulfanyl134thiadiazol2yl)4thiophen2yl3468tetrahydroquinoline25dione
CC1(CC2=C(C(CC(=O)N2C3=NN=C(S3)SCC=C)C4=CC=CS4)C(=O)C1)C
InChI=1SC20H21N3O2S3c1472719222118(2819)23131020(23)1114(24)17(13)12(916(23)25)156582615h46812H17911H223H3
MFCD05855838
ZINC000012402393
ZINC000012402394

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Available files

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