Vitas-M small molecule compound
(6E)-6-{[1-(4-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224421
SMILES CCCc1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(cc3)OCC)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 C23H25N5O2S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2S/c1-5-7-20-26-28-21(24)19(22(29)25-23(28)31-20)13-16-12-14(3)27(15(16)4)17-8-10-18(11-9-17)30-6-2/h8-13,24H,5-7H2,1-4H3/b19-13+,24-21-InChIKey
JQAKZKIPDBCITG-ZFGFYEEASA-NSynonyms
844448-23-3(6E)6((1(4ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(4ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2propyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844448233
CCCc1sc2=NC(=O)C(=Cc3cc(n(c3C)c3ccc(cc3)OCC)C)C(=N)n2n1
MFCD04155711
ZINC000009191953
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