Vitas-M small molecule compound
(6E)-6-{[1-(2-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-pentyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224648
SMILES CCCCCc1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3OCC)C)/C(=N)n2n1
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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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-5-7-8-13-22-28-30-23(26)19(24(31)27-25(30)33-22)15-18-14-16(3)29(17(18)4)20-11-9-10-12-21(20)32-6-2/h9-12,14-15,26H,5-8,13H2,1-4H3/b19-15+,26-23-InChIKey
RBFIOGYICAQZEE-QYWMCVBSSA-NSynonyms
850243-12-8(6E)6((1(2ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2pentyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2pentyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850243128
CCCCCc1sc2=NC(=O)C(=Cc3cc(n(c3C)c3ccccc3OCC)C)C(=N)n2n1
MFCD05692093
ZINC000009309817
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