Vitas-M small molecule compound
(6E)-6-({2,5-dimethyl-1-[4-(propan-2-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL232756
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1ccc(cc1)C(C)C)C)c1cccnc1
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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 C26H24N6OS MW 468.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N6OS/c1-15(2)18-7-9-21(10-8-18)31-16(3)12-20(17(31)4)13-22-23(27)32-26(29-24(22)33)34-25(30-32)19-6-5-11-28-14-19/h5-15,27H,1-4H3/b22-13+,27-23-InChIKey
IKHUMRPCDIQSBL-ZHJGTXQPSA-NSynonyms
844464-07-9(6E)6((25dimethyl1(4(propan2yl)phenyl)1Hpyrrol3yl)methylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(4isopropylphenyl)25dimethyl1Hpyrrol3yl)methylene)2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844464079
MFCD04157817
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1ccc(cc1)C(C)C)C)c1cccnc1
ZINC000009192460
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