Vitas-M small molecule compound
(5E)-1-(2-chlorophenyl)-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK113049
SMILES Oc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1Cl
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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 C23H18ClN3O3S MW 451.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O3S/c1-13-11-15(14(2)26(13)16-7-9-17(28)10-8-16)12-18-21(29)25-23(31)27(22(18)30)20-6-4-3-5-19(20)24/h3-12,28H,1-2H3,(H,25,29,31)/b18-12+InChIKey
CHZNHEKKRJVNDB-LDADJPATSA-NSynonyms
(5E)1(2CHLOROPHENYL)5((1(4HYDROXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(2CHLOROPHENYL)5((1(4HYDROXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CC=C(C=C2)O)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4Cl
InChI=1SC23H18ClN3O3Sc1131115(14(2)26(13)167917(28)10816)121821(29)2523(31)27(22(18)30)20643519(20)24h31228H12H3(H252931)b1812+
MFCD05149566
Oc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)NC(=S)N(C1=O)c1ccccc1Cl
ZINC000001410520
ZINC01410520
ZINC1410520
Check stock
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