Vitas-M small molecule compound
(6E)-6-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(4-fluorophenyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224905
SMILES Fc1ccc(cc1)c1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(c(c3)Cl)C)C)/C(=N)n2n1
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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 C25H19ClFN5OS MW 491.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClFN5OS/c1-13-4-9-19(12-21(13)26)31-14(2)10-17(15(31)3)11-20-22(28)32-25(29-23(20)33)34-24(30-32)16-5-7-18(27)8-6-16/h4-12,28H,1-3H3/b20-11+,28-22-InChIKey
NTXNNBIQQWJQQE-SVILPCAHSA-NSynonyms
850157-36-7(6E)6((1(3chloro4methylphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(4fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro4methylphenyl)25dimethyl1Hpyrrol3yl)methylene)2(4fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850157367
Fc1ccc(cc1)c1sc2=NC(=O)C(=Cc3cc(n(c3C)c3ccc(c(c3)Cl)C)C)C(=N)n2n1
MFCD05689785
ZINC000009309693
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