Vitas-M small molecule compound
(5E)-1-(2-methylphenyl)-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL057593
SMILES CCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1C)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(17-9-5-7-11-20(17)25)13-18-21(27)24-23(29)26(22(18)28)19-10-6-4-8-15(19)2/h4-11,13-14H,3,12H2,1-2H3,(H,24,27,29)/b18-13+InChIKey
YIPKGRQFCCOFBQ-QGOAFFKASA-NSynonyms
585560-43-6(5E)1(2methylphenyl)5((1propyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(2METHYLPHENYL)5((1PROPYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
585560436
CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4C
CCCn1cc(c2c1cccc2)C=C1C(=O)N=C(N(C1=O)c1ccccc1C)S
InChI=1SC23H21N3O2Sc1312251416(179571120(17)25)131821(27)2423(29)26(22(18)28)191064815(19)2h4111314H312H212H3(H242729)b1813+
MFCD05732414
ZINC000017248395
ZINC17248395
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