Vitas-M small molecule compound
(6E)-6-[3-bromo-4-(dimethylamino)benzylidene]-5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL237699
SMILES O=C(N1CCOCC1)Cc1nn2c(=NC(=O)/C(=C/c3ccc(c(c3)Br)N(C)C)/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 C20H21BrN6O3S MW 505.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN6O3S/c1-25(2)15-4-3-12(10-14(15)21)9-13-18(22)27-20(23-19(13)29)31-16(24-27)11-17(28)26-5-7-30-8-6-26/h3-4,9-10,22H,5-8,11H2,1-2H3/b13-9+,22-18-InChIKey
MIPOILFRNBXDTH-BGMLCNFBSA-NSynonyms
850763-01-8(6E)6(3bromo4(dimethylamino)benzylidene)5imino2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6(3bromo4(dimethylamino)benzylidene)5imino2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850763018
MFCD05695073
O=C(N1CCOCC1)Cc1nn2c(=NC(=O)C(=Cc3ccc(c(c3)Br)N(C)C)C2=N)s1
ZINC000009291438
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