Vitas-M small molecule compound
(6E)-6-[(2,5-dimethyl-1-phenyl-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
STL224180
SMILES CCCCCc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3)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 C23H25N5OS MW 419.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5OS/c1-4-5-7-12-20-26-28-21(24)19(22(29)25-23(28)30-20)14-17-13-15(2)27(16(17)3)18-10-8-6-9-11-18/h6,8-11,13-14,24H,4-5,7,12H2,1-3H3/b19-14+,24-21-InChIKey
SDDHBGUOBPWXPC-KSGJJIRRSA-NSynonyms
844649-67-8(6E)6((25dimethyl1phenyl1Hpyrrol3yl)methylidene)5imino2pentyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1phenyl1Hpyrrol3yl)methylene)5imino2pentyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844649678
CCCCCc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccccc3)C)C2=N)s1
MFCD04158967
ZINC000005151269
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