Vitas-M small molecule compound
(5Z)-1-(4-fluorophenyl)-5-[2-methyl-4-(piperidin-1-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187429
SMILES Fc1ccc(cc1)N1C(=S)NC(=O)/C(=C/c2ccc(cc2C)N2CCCCC2)/C1=O
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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 C23H22FN3O2S MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O2S/c1-15-13-19(26-11-3-2-4-12-26)8-5-16(15)14-20-21(28)25-23(30)27(22(20)29)18-9-6-17(24)7-10-18/h5-10,13-14H,2-4,11-12H2,1H3,(H,25,28,30)/b20-14-InChIKey
WLVUSYMPOUIQPU-ZHZULCJRSA-NSynonyms
(5Z)1(4FLUOROPHENYL)5((2METHYL4PIPERIDIN1YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4FLUOROPHENYL)5(2METHYL4(PIPERIDIN1YL)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC1=C(C=CC(=C1)N2CCCCC2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccc(cc2C)N2CCCCC2)C1=O
InChI=1SC23H22FN3O2Sc1151319(26113241226)8516(15)142021(28)2523(30)27(22(20)29)189617(24)71018h5101314H241112H21H3(H252830)b2014
MFCD03706647
ZINC000001151032
ZINC01151032
ZINC1151032
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