Vitas-M small molecule compound
(5E)-1-(4-methylphenyl)-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL041840
SMILES CCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)C)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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-3-12-25-14-16(18-6-4-5-7-20(18)25)13-19-21(27)24-23(29)26(22(19)28)17-10-8-15(2)9-11-17/h4-11,13-14H,3,12H2,1-2H3,(H,24,27,29)/b19-13+InChIKey
OICVIZUIUCFGRZ-CPNJWEJPSA-NSynonyms
577985-29-6(5E)1(4methylphenyl)5((1propyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(4METHYLPHENYL)5((1PROPYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
577985296
CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C
CCCn1cc(c2c1cccc2)C=C1C(=O)N=C(N(C1=O)c1ccc(cc1)C)S
InChI=1SC23H21N3O2Sc1312251416(18645720(18)25)131921(27)2423(29)26(22(19)28)1710815(2)91117h4111314H312H212H3(H242729)b1913+
MFCD05734248
ZINC000002336253
ZINC2336253
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