Vitas-M small molecule compound
(5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-1-(2-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL056686
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1OC)S
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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 C24H25N3O3S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3S/c1-3-4-12-26-13-11-17-14-16(9-10-19(17)26)15-18-22(28)25-24(31)27(23(18)29)20-7-5-6-8-21(20)30-2/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,25,28,31)/b18-15+InChIKey
CHSRKJSTUBWURM-OBGWFSINSA-NSynonyms
577788-37-5(5E)5((1butyl23dihydro1Hindol5yl)methylidene)1(2methoxyphenyl)2sulfanylpyrimidine46(1H5H)dione
(5E)5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)1(2METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
577788375
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4OC
CCCCN1CCc2c1ccc(c2)C=C1C(=O)N=C(N(C1=O)c1ccccc1OC)S
InChI=1SC24H25N3O3Sc13412261311171416(91019(17)26)151822(28)2524(31)27(23(18)29)20756821(20)302h5101415H341113H212H3(H252831)b1815+
MFCD05730118
ZINC000002378849
ZINC2378849
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