Vitas-M small molecule compound
(6E)-6-{4-[3-(2,4-dimethylphenoxy)propoxy]benzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK078368
SMILES CCc1nn2c(=NC(=O)/C(=C/c3ccc(cc3)OCCCOc3ccc(cc3C)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 C25H26N4O3S MW 462.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3S/c1-4-22-28-29-23(26)20(24(30)27-25(29)33-22)15-18-7-9-19(10-8-18)31-12-5-13-32-21-11-6-16(2)14-17(21)3/h6-11,14-15,26H,4-5,12-13H2,1-3H3/b20-15+,26-23+InChIKey
BMRMOTIQTJXICI-ZNURURQISA-NSynonyms
(6E)6(4(3(24dimethylphenoxy)propoxy)benzylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCc1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCCCOc3ccc(cc3C)C)C2=N)s1
MFCD08672846
STK078368
ZINC000009659995
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