Vitas-M small molecule compound
1,3-diphenyl-5-(1-{[2-(pyridin-3-yl)piperidin-1-yl]amino}ethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL338256
SMILES C/C(=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1)/NN1CCCCC1c1cccnc1
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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 C28H27N5O2S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O2S/c1-20(30-31-18-9-8-16-24(31)21-11-10-17-29-19-21)25-26(34)32(22-12-4-2-5-13-22)28(36)33(27(25)35)23-14-6-3-7-15-23/h2-7,10-15,17,19,24,30H,8-9,16,18H2,1H3InChIKey
FRVLITQXWXIAOU-UHFFFAOYSA-NSynonyms
13diphenyl5(1((2(pyridin3yl)piperidin1yl)amino)ethylidene)2thioxodihydropyrimidine46(1H5H)dione
13DIPHENYL5(1((2PYRIDIN3YLPIPERIDIN1YL)AMINO)ETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC(=C1C(=O)N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NN4CCCCC4C5=CN=CC=C5
CC(=C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1)NN1CCCCC1c1cccnc1
InChI=1SC28H27N5O2Sc120(303118981624(31)21111017291921)2526(34)32(22124251322)28(36)33(27(25)35)23146371523h27101517192430H891618H21H3
MFCD03686657
ZINC000009461155
ZINC000009461156
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