Vitas-M small molecule compound
(6E)-6-{[1-(3-chloro-2-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(thiophen-2-ylmethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224920
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1cccc(c1C)Cl)C)Cc1cccs1
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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 C24H20ClN5OS2 MW 494.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN5OS2/c1-13-10-16(15(3)29(13)20-8-4-7-19(25)14(20)2)11-18-22(26)30-24(27-23(18)31)33-21(28-30)12-17-6-5-9-32-17/h4-11,26H,12H2,1-3H3/b18-11+,26-22-InChIKey
CMRGVFJFUJIIKX-QCAKGMMDSA-NSynonyms
848916-63-2(6E)6((1(3chloro2methylphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(thiophen2ylmethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro2methylphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(thiophen2ylmethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848916632
MFCD04197999
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1cccc(c1C)Cl)C)Cc1cccs1
ZINC000009210570
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