Vitas-M small molecule compound
(6Z)-2-cyclohexyl-6-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224161
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(n(c1C)c1cccc2c1cccc2)C)C1CCCCC1
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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 C28H27N5OS MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5OS/c1-17-15-21(18(2)32(17)24-14-8-12-19-9-6-7-13-22(19)24)16-23-25(29)33-28(30-26(23)34)35-27(31-33)20-10-4-3-5-11-20/h6-9,12-16,20,29H,3-5,10-11H2,1-2H3/b23-16-,29-25-InChIKey
UUKUUUQHFFOKAH-DQHRAUICSA-NSynonyms
(6Z)2cyclohexyl6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2cyclohexyl6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD24857668
ZINC000033628887
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