Vitas-M small molecule compound
(6E)-6-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK554964
SMILES O=C(N1CCCC1)Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(c(c3)Cl)C)C)/C2=N)s1
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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 C25H25ClN6O2S MW 509.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN6O2S/c1-14-6-7-18(12-20(14)26)31-15(2)10-17(16(31)3)11-19-23(27)32-25(28-24(19)34)35-21(29-32)13-22(33)30-8-4-5-9-30/h6-7,10-12,27H,4-5,8-9,13H2,1-3H3/b19-11+,27-23-InChIKey
FTRWUVCLPSMTRS-JNGFHFLTSA-NSynonyms
840495-22-9(6E)6((1(3chloro4methylphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro4methylphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
840495229
MFCD04007934
O=C(N1CCCC1)Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc(c(c3)Cl)C)C)C2=N)s1
ZINC000009463659
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