Vitas-M small molecule compound
(6Z)-2-cyclohexyl-5-imino-6-[(1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-pyrrol-2-yl)methylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK027678
SMILES C=CCc1ccccc1OCCn1cccc1/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C27H29N5O2S MW 487.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S/c1-2-9-19-10-6-7-14-23(19)34-17-16-31-15-8-13-21(31)18-22-24(28)32-27(29-25(22)33)35-26(30-32)20-11-4-3-5-12-20/h2,6-8,10,13-15,18,20,28H,1,3-5,9,11-12,16-17H2/b22-18-,28-24-InChIKey
WGFCSZNBENETPL-IRHOYIQTSA-NSynonyms
(6Z)2cyclohexyl5imino6((1(2(2(prop2en1yl)phenoxy)ethyl)1Hpyrrol2yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
C=CCc1ccccc1OCCn1cccc1C=C1C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
MFCD08050142
STK027678
ZINC000030855791
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