Vitas-M small molecule compound
(5E)-1-(2-fluorophenyl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK845754
SMILES O=C1N=C(S)N(C(=O)/C/1=C/c1cccc2c1cccc2)c1ccccc1F
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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 C21H13FN2O2S MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13FN2O2S/c22-17-10-3-4-11-18(17)24-20(26)16(19(25)23-21(24)27)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-12H,(H,23,25,27)/b16-12+InChIKey
CENLOHOENZSIND-FOWTUZBSSA-NSynonyms
374547-03-2(5E)1(2FLUOROPHENYL)5(NAPHTHALEN1YLMETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(2fluorophenyl)5(naphthalen1ylmethylidene)2sulfanylpyrimidine46(1H5H)dione
374547032
C1=CC=C2C(=C1)C=CC=C2C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F
InChI=1SC21H13FN2O2Sc221710341118(17)2420(26)16(19(25)2321(24)27)121485713612915(13)14h112H(H232527)b1612+
MFCD03809060
O=C1N=C(S)N(C(=O)C1=Cc1cccc2c1cccc2)c1ccccc1F
ZINC000001245620
ZINC1245620
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