Vitas-M small molecule compound
(6Z)-2-butyl-5-imino-6-{[1-(naphthalen-1-ylmethyl)-1H-pyrrol-2-yl]methylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK052057
SMILES CCCCc1nn2c(=NC(=O)/C(=C\c3cccn3Cc3cccc4c3cccc4)/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 C25H23N5OS MW 441.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5OS/c1-2-3-13-22-28-30-23(26)21(24(31)27-25(30)32-22)15-19-11-7-14-29(19)16-18-10-6-9-17-8-4-5-12-20(17)18/h4-12,14-15,26H,2-3,13,16H2,1H3/b21-15-,26-23-InChIKey
ZVXQMWDCAOYLRZ-SVHFWYAISA-NSynonyms
(6Z)2butyl5imino6((1(naphthalen1ylmethyl)1Hpyrrol2yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCc1nn2c(=NC(=O)C(=Cc3cccn3Cc3cccc4c3cccc4)C2=N)s1
MFCD08051140
STK052057
ZINC000009434782
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