Vitas-M small molecule compound
(6E)-6-({2,5-dimethyl-1-[4-(propan-2-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224238
SMILES O=C1N=c2scnn2C(=N)/C/1=C\c1cc(n(c1C)c1ccc(cc1)C(C)C)C
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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 C21H21N5OS MW 391.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5OS/c1-12(2)15-5-7-17(8-6-15)25-13(3)9-16(14(25)4)10-18-19(22)26-21(24-20(18)27)28-11-23-26/h5-12,22H,1-4H3/b18-10+,22-19-InChIKey
SQZPWYVLIDVXRC-ZMANXLTQSA-NSynonyms
845664-13-3(6E)6((25dimethyl1(4(propan2yl)phenyl)1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(4isopropylphenyl)25dimethyl1Hpyrrol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
845664133
MFCD04168737
O=C1N=c2scnn2C(=N)C1=Cc1cc(n(c1C)c1ccc(cc1)C(C)C)C
ZINC000005180430
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