Vitas-M small molecule compound
4-(2,3-dichlorophenyl)-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
STK774592
SMILES C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1cccc(c1Cl)Cl
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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 C20H17Cl2N3O2S2 MW 466.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2N3O2S2/c1-2-9-28-20-24-23-19(29-20)25-14-7-4-8-15(26)17(14)12(10-16(25)27)11-5-3-6-13(21)18(11)22/h2-3,5-6,12H,1,4,7-10H2InChIKey
ZKEYJWWCPFBMHZ-UHFFFAOYSA-NSynonyms
4(23dichlorophenyl)1(5(prop2en1ylsulfanyl)134thiadiazol2yl)4678tetrahydroquinoline25(1H3H)dione
4(23dichlorophenyl)1(5prop2enylsulfanyl134thiadiazol2yl)4678tetrahydro3Hquinoline25dione
C=CCSC1=NN=C(S1)N2C3=C(C(CC2=O)C4=C(C(=CC=C4)Cl)Cl)C(=O)CCC3
InChI=1SC20H17Cl2N3O2S2c1292820242319(2920)251474815(26)17(14)12(1016(25)27)1153613(21)18(11)22h235612H14710H2
MFCD04061022
ZINC000003629295
ZINC000003629297
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