Vitas-M small molecule compound
(5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-1-cyclopropyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL049919
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)C1CC1)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 C20H23N3O2S MW 369.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O2S/c1-2-3-9-22-10-8-14-11-13(4-7-17(14)22)12-16-18(24)21-20(26)23(19(16)25)15-5-6-15/h4,7,11-12,15H,2-3,5-6,8-10H2,1H3,(H,21,24,26)/b16-12+InChIKey
NPGXUZLXHNHLDZ-FOWTUZBSSA-NSynonyms
578721-79-6(5E)5((1butyl23dihydro1Hindol5yl)methylidene)1cyclopropyl2sulfanylpyrimidine46(1H5H)dione
(5E)5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)1CYCLOPROPYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((1BUTYLINDOLIN5YL)METHYLENE)1CYCLOPROPYL2THIOXOHEXAHYDROPYRIMIDINE46QUINONE
578721796
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)C4CC4
CCCCN1CCc2c1ccc(c2)C=C1C(=O)N=C(N(C1=O)C1CC1)S
InChI=1SC20H23N3O2Sc123922108141113(4717(14)22)121618(24)2120(26)23(19(16)25)155615h47111215H2356810H21H3(H212426)b1612+
MFCD05727820
ZINC000002389548
ZINC2389548
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