Vitas-M small molecule compound
(6E)-6-({2,5-dimethyl-1-[4-(propan-2-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-2-(furan-2-yl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224588
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1ccc(cc1)C(C)C)C)c1ccco1
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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 C25H23N5O2S MW 457.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O2S/c1-14(2)17-7-9-19(10-8-17)29-15(3)12-18(16(29)4)13-20-22(26)30-25(27-23(20)31)33-24(28-30)21-6-5-11-32-21/h5-14,26H,1-4H3/b20-13+,26-22-InChIKey
HFWWKBHMUWSZLF-ANUUQEJFSA-NSynonyms
847365-69-9(6E)6((25dimethyl1(4(propan2yl)phenyl)1Hpyrrol3yl)methylidene)2(furan2yl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2(furan2yl)5imino6((1(4isopropylphenyl)25dimethyl1Hpyrrol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
847365699
MFCD04180532
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1ccc(cc1)C(C)C)C)c1ccco1
ZINC000009158798
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