Vitas-M small molecule compound
5-{[1-(2-chloro-6-fluorobenzyl)-1H-indol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK026489
SMILES S=C1NC(=O)C(=Cc2cn(c3c2cccc3)Cc2c(F)cccc2Cl)C(=O)N1
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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 C20H13ClFN3O2S MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClFN3O2S/c21-15-5-3-6-16(22)14(15)10-25-9-11(12-4-1-2-7-17(12)25)8-13-18(26)23-20(28)24-19(13)27/h1-9H,10H2,(H2,23,24,26,27,28)InChIKey
XORMKDCPHUCJDK-UHFFFAOYSA-NSynonyms
5((1((2CHLORO6FLUOROPHENYL)METHYL)INDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5((1(2CHLORO6FLUOROBENZYL)1HINDOL3YL)METHYLENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
5((1(2CHLORO6FLUOROBENZYL)1HINDOL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC=C2C(=C1)C(=CN2CC3=C(C=CC=C3Cl)F)C=C4C(=O)NC(=S)NC4=O
InChI=1SC20H13ClFN3O2Sc211553616(22)14(15)1025911(12412717(12)25)81318(26)2320(28)2419(13)27h19H10H2(H22324262728)
MFCD01784438
S=C1NC(=O)C(=Cc2cn(c3c2cccc3)Cc2c(F)cccc2Cl)C(=O)N1
STK026489
ZINC000000666475
ZINC00666475
ZINC666475
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