Vitas-M small molecule compound
(6Z)-6-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(2-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224673
SMILES Cc1ccccc1c1nn2c(=NC(=O)/C(=C\c3cc(n(c3C)c3c(C)cccc3C)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 C27H25N5OS MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5OS/c1-15-9-6-7-12-21(15)26-30-32-24(28)22(25(33)29-27(32)34-26)14-20-13-18(4)31(19(20)5)23-16(2)10-8-11-17(23)3/h6-14,28H,1-5H3/b22-14-,28-24-InChIKey
QWQFYTOEDLLXIN-JKNGSGMMSA-NSynonyms
(6Z)6((1(26dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(26dimethylphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(otolyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1ccccc1c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3c(C)cccc3C)C)C2=N)s1
MFCD24857851
ZINC000041108100
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