Vitas-M small molecule compound
(6Z)-5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-6-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL040879
SMILES O=C(N1CCOCC1)Cc1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3cccc(c3)[N+](=O)[O-])/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 C22H18N6O6S MW 494.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N6O6S/c23-20-16(11-15-4-5-17(34-15)13-2-1-3-14(10-13)28(31)32)21(30)24-22-27(20)25-18(35-22)12-19(29)26-6-8-33-9-7-26/h1-5,10-11,23H,6-9,12H2/b16-11-,23-20-InChIKey
BVUDOHAXVORKLL-CDTXGEGNSA-NSynonyms
714246-62-5(6Z)5imino2(2(morpholin4yl)2oxoethyl)6((5(3nitrophenyl)furan2yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino2(2morpholino2oxoethyl)6((5(3nitrophenyl)furan2yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
714246625
MFCD04195936
O=C(N1CCOCC1)Cc1nn2c(=NC(=O)C(=Cc3ccc(o3)c3cccc(c3)(N+)(=O)(O))C2=N)s1
ZINC000101171469
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