Vitas-M small molecule compound
(6E)-5-imino-2-(pentan-3-yl)-6-(3,4,5-trimethoxybenzylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712789
SMILES CCC(c1nn2c(=NC(=O)/C(=C/c3cc(OC)c(c(c3)OC)OC)/C2=N)s1)CC
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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 C20H24N4O4S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O4S/c1-6-12(7-2)19-23-24-17(21)13(18(25)22-20(24)29-19)8-11-9-14(26-3)16(28-5)15(10-11)27-4/h8-10,12,21H,6-7H2,1-5H3/b13-8+,21-17-InChIKey
MLYIOYSIVIZIGE-JWIFREANSA-NSynonyms
877786-02-2(6E)5imino2(pentan3yl)6(345trimethoxybenzylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino2(pentan3yl)6(345trimethoxybenzylidene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877786022
CCC(c1nn2c(=NC(=O)C(=Cc3cc(OC)c(c(c3)OC)OC)C2=N)s1)CC
MFCD05701240
ZINC000005562128
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