Vitas-M small molecule compound
(5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-1-ethyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL050691
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)CC)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 C19H23N3O2S MW 357.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O2S/c1-3-5-9-21-10-8-14-11-13(6-7-16(14)21)12-15-17(23)20-19(25)22(4-2)18(15)24/h6-7,11-12H,3-5,8-10H2,1-2H3,(H,20,23,25)/b15-12+InChIKey
BRFJXZNGBQPHFM-NTCAYCPXSA-NSynonyms
577987-43-0(5E)5((1butyl23dihydro1Hindol5yl)methylidene)1ethyl2sulfanylpyrimidine46(1H5H)dione
(5E)5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)1ETHYL2SULFANYLIDENE13DIAZINANE46DIONE
577987430
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)CC
CCCCN1CCc2c1ccc(c2)C=C1C(=O)N=C(N(C1=O)CC)S
InChI=1SC19H23N3O2Sc135921108141113(6716(14)21)121517(23)2019(25)22(42)18(15)24h671112H35810H212H3(H202325)b1512+
MFCD05726155
ZINC000002596269
ZINC2596269
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