Vitas-M small molecule compound
7,7-dimethyl-4-phenyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK774528
SMILES C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1
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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 C22H23N3O2S2 MW 425.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O2S2/c1-4-10-28-21-24-23-20(29-21)25-16-12-22(2,3)13-17(26)19(16)15(11-18(25)27)14-8-6-5-7-9-14/h4-9,15H,1,10-13H2,2-3H3InChIKey
DSHLJIDPNFYGMW-UHFFFAOYSA-NSynonyms
77dimethyl4phenyl1(5(prop2en1ylsulfanyl)134thiadiazol2yl)4678tetrahydroquinoline25(1H3H)dione
77dimethyl4phenyl1(5prop2enylsulfanyl134thiadiazol2yl)3468tetrahydroquinoline25dione
CC1(CC2=C(C(CC(=O)N2C3=NN=C(S3)SCC=C)C4=CC=CC=C4)C(=O)C1)C
InChI=1SC22H23N3O2S2c14102821242320(2921)25161222(23)1317(26)19(16)15(1118(25)27)148657914h4915H11013H223H3
MFCD04060939
ZINC000002504235
ZINC000002504236
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