Vitas-M small molecule compound
(6Z)-6-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-[(2-methylphenoxy)methyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224825
SMILES Cc1cccc(c1)n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1C
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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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-16-8-7-10-21(12-16)31-18(3)13-20(19(31)4)14-22-25(28)32-27(29-26(22)33)35-24(30-32)15-34-23-11-6-5-9-17(23)2/h5-14,28H,15H2,1-4H3/b22-14-,28-25-InChIKey
OLXUCJIRWHIODS-OUGGDVFGSA-NSynonyms
(6Z)6((25dimethyl1(3methylphenyl)1Hpyrrol3yl)methylidene)5imino2((2methylphenoxy)methyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(mtolyl)1Hpyrrol3yl)methylene)5imino2((otolyloxy)methyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1cccc(c1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1C
MFCD24857909
ZINC000041108346
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