Vitas-M small molecule compound
(6E)-6-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK082176
SMILES CCc1nn2c(=NC(=O)/C(=C/c3ccc(o3)c3ccc(cc3)Cl)/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 C18H13ClN4O2S MW 384.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN4O2S/c1-2-15-22-23-16(20)13(17(24)21-18(23)26-15)9-12-7-8-14(25-12)10-3-5-11(19)6-4-10/h3-9,20H,2H2,1H3/b13-9+,20-16+InChIKey
YNBUEGMAGPIROI-OAAPSQRLSA-NSynonyms
(6E)6((5(4chlorophenyl)furan2yl)methylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6((5(4chlorophenyl)furan2yl)methylene)2ethyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCc1nn2c(=NC(=O)C(=Cc3ccc(o3)c3ccc(cc3)Cl)C2=N)s1
MFCD03183224
STK082176
ZINC000003864202
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