Vitas-M small molecule compound
(6E)-6-[(1-benzyl-1H-indol-3-yl)methylidene]-5-imino-2-[2-oxo-2-(piperidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL232610
SMILES O=C(N1CCCCC1)Cc1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)Cc3ccccc3)/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 C28H26N6O2S MW 510.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N6O2S/c29-26-22(15-20-18-33(17-19-9-3-1-4-10-19)23-12-6-5-11-21(20)23)27(36)30-28-34(26)31-24(37-28)16-25(35)32-13-7-2-8-14-32/h1,3-6,9-12,15,18,29H,2,7-8,13-14,16-17H2/b22-15+,29-26-InChIKey
VHMXRTVIASBQHH-DGDFDKPFSA-NSynonyms
847916-85-2(6E)6((1benzyl1Hindol3yl)methylidene)5imino2(2oxo2(piperidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1benzyl1Hindol3yl)methylene)5imino2(2oxo2(piperidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
847916852
MFCD04186226
O=C(N1CCCCC1)Cc1nn2c(=NC(=O)C(=Cc3cn(c4c3cccc4)Cc3ccccc3)C2=N)s1
ZINC000009161291
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