Vitas-M small molecule compound
(5E)-1-phenyl-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL037685
SMILES O=C1N=C(S)N(C(=O)/C/1=C/NN1CCCCC1c1cccnc1)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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c27-19-17(20(28)26(21(29)24-19)16-8-2-1-3-9-16)14-23-25-12-5-4-10-18(25)15-7-6-11-22-13-15/h1-3,6-9,11,13-14,18,23H,4-5,10,12H2,(H,24,27,29)/b17-14+InChIKey
UCKILGJSJQZBJF-SAPNQHFASA-NSynonyms
(5E)1phenyl5(((2(pyridin3yl)piperidin1yl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1phenyl5(((2pyridin3ylpiperidin1yl)amino)methylidene)2sulfanylidene13diazinane46dione
C1CCN(C(C1)C2=CN=CC=C2)NC=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4
InChI=1SC21H21N5O2Sc271917(20(28)26(21(29)2419)168213916)14232512541018(25)157611221315h13691113141823H451012H2(H242729)b1714+
MFCD03815996
O=C1N=C(S)N(C(=O)C1=CNN1CCCCC1c1cccnc1)c1ccccc1
ZINC000002314441
ZINC000006898832
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