Vitas-M small molecule compound
(6E)-6-{[1-(2,5-dimethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL225072
SMILES CCC(c1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cc(OC)ccc3OC)C)/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 C25H29N5O3S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3S/c1-7-16(8-2)24-28-30-22(26)19(23(31)27-25(30)34-24)12-17-11-14(3)29(15(17)4)20-13-18(32-5)9-10-21(20)33-6/h9-13,16,26H,7-8H2,1-6H3/b19-12+,26-22-InChIKey
GLHMWOUZNQUROI-WPNLKJQRSA-NSynonyms
845652-04-2(6E)6((1(25dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(pentan3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(25dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(pentan3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
845652042
CCC(c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cc(OC)ccc3OC)C)C2=N)s1)CC
MFCD04167805
ZINC000009281561
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