Vitas-M small molecule compound
(5E)-1-(3,4-dichlorophenyl)-5-(1H-pyrrol-2-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL367391
SMILES S=C1NC(=O)/C(=C\c2ccc[nH]2)/C(=O)N1c1ccc(c(c1)Cl)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 C15H9Cl2N3O2S MW 366.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9Cl2N3O2S/c16-11-4-3-9(7-12(11)17)20-14(22)10(13(21)19-15(20)23)6-8-2-1-5-18-8/h1-7,18H,(H,19,21,23)/b10-6+InChIKey
SKTWJQHFISJCJK-UXBLZVDNSA-NSynonyms
(5E)1(34DICHLOROPHENYL)5(1HPYRROL2YLMETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(34dichlorophenyl)5(1Hpyrrol2ylmethylidene)2thioxodihydropyrimidine46(1H5H)dione
C1=CNC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC15H9Cl2N3O2Sc1611439(712(11)17)2014(22)10(13(21)1915(20)23)68215188h1718H(H192123)b106+
MFCD02220311
S=C1NC(=O)C(=Cc2ccc(nH)2)C(=O)N1c1ccc(c(c1)Cl)Cl
ZINC000001176148
ZINC01176148
ZINC1176148
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