Vitas-M small molecule compound
(5Z)-1-(4-chlorophenyl)-5-(3,5-dichloro-4-methoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187985
SMILES COc1c(Cl)cc(cc1Cl)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)Cl
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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 C18H11Cl3N2O3S MW 441.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11Cl3N2O3S/c1-26-15-13(20)7-9(8-14(15)21)6-12-16(24)22-18(27)23(17(12)25)11-4-2-10(19)3-5-11/h2-8H,1H3,(H,22,24,27)/b12-6-InChIKey
AHJBFKNSUPJHGF-SDQBBNPISA-NSynonyms
(5Z)1(4CHLOROPHENYL)5((35DICHLORO4METHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4CHLOROPHENYL)5(35DICHLORO4METHOXYBENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
COC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl)Cl
COc1c(Cl)cc(cc1Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)Cl
InChI=1SC18H11Cl3N2O3Sc1261513(20)79(814(15)21)61216(24)2218(27)23(17(12)25)114210(19)3511h28H1H3(H222427)b126
MFCD02629347
ZINC000001198430
ZINC01198430
ZINC1198430
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