Vitas-M small molecule compound
(6E)-5-imino-6-{4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712852
SMILES CCC(c1nn2c(=NC(=O)/C(=C/c3ccc(cc3)OCCOc3ccc(cc3)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 C26H28N4O4S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O4S/c1-4-18(5-2)25-29-30-23(27)22(24(31)28-26(30)35-25)16-17-6-8-20(9-7-17)33-14-15-34-21-12-10-19(32-3)11-13-21/h6-13,16,18,27H,4-5,14-15H2,1-3H3/b22-16+,27-23-InChIKey
SGUYYBNZDMFALU-IVKSQUDHSA-NSynonyms
849924-07-8(6E)5imino6(4(2(4methoxyphenoxy)ethoxy)benzylidene)2(pentan3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6(4(2(4methoxyphenoxy)ethoxy)benzylidene)2(pentan3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
849924078
CCC(c1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCCOc3ccc(cc3)OC)C2=N)s1)CC
MFCD05689659
ZINC000009501647
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