Vitas-M small molecule compound
(6E)-6-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(furan-2-yl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224834
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)c1ccco1
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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 C22H15Cl2N5O2S MW 484.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl2N5O2S/c1-11-8-13(12(2)28(11)14-5-6-16(23)17(24)10-14)9-15-19(25)29-22(26-20(15)30)32-21(27-29)18-4-3-7-31-18/h3-10,25H,1-2H3/b15-9+,25-19-InChIKey
PLUJEVVKUOEJCA-ANXSCLOSSA-NSynonyms
1392297-92-5(6E)6((1(34dichlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)2(furan2yl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(34dichlorophenyl)25dimethyl1Hpyrrol3yl)methylene)2(furan2yl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
1392297925
MFCD05701976
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)c1ccco1
ZINC000009293411
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