Vitas-M small molecule compound
(5Z)-1-(4-iodophenyl)-5-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK530087
SMILES COc1ccc(cc1CSc1ccccn1)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)I
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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 C24H18IN3O4S MW 571.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18IN3O4S/c1-32-20-10-5-15(12-16(20)14-33-21-4-2-3-11-26-21)13-19-22(29)27-24(31)28(23(19)30)18-8-6-17(25)7-9-18/h2-13H,14H2,1H3,(H,27,29,31)/b19-13-InChIKey
KRMFNFMGFVNKBK-UYRXBGFRSA-NSynonyms
(5Z)1(4IODOPHENYL)5((4METHOXY3(PYRIDIN2YLSULFANYLMETHYL)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(4iodophenyl)5(4methoxy3((pyridin2ylsulfanyl)methyl)benzylidene)pyrimidine246(1H3H5H)trione
(Z)1(4iodophenyl)5(4methoxy3((pyridin2ylthio)methyl)benzylidene)pyrimidine246(1H3H5H)trione
COC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)I)CSC4=CC=CC=N4
COc1ccc(cc1CSc1ccccn1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)I
InChI=1SC24H18IN3O4Sc1322010515(1216(20)143321423112621)131922(29)2724(31)28(23(19)30)188617(25)7918h213H14H21H3(H272931)b1913
MFCD02233753
ZINC000097966363
ZINC97966363
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