Vitas-M small molecule compound
(5E)-1-(3,5-dimethylphenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK190191
SMILES C#CCn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)c1cc(C)cc(c1)C
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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 C24H19N3O2S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O2S/c1-4-9-26-14-17(19-7-5-6-8-21(19)26)13-20-22(28)25-24(30)27(23(20)29)18-11-15(2)10-16(3)12-18/h1,5-8,10-14H,9H2,2-3H3,(H,25,28,30)/b20-13+InChIKey
AHEFDUBRJKDKSU-DEDYPNTBSA-NSynonyms
(5E)1(35DIMETHYLPHENYL)5((1(PROP2YN1YL)1HINDOL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(35DIMETHYLPHENYL)5((1PROP2YNYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
C#CCn1cc(c2c1cccc2)C=C1C(=O)NC(=S)N(C1=O)c1cc(C)cc(c1)C
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC#C)C(=O)NC2=S)C
InChI=1SC24H19N3O2Sc149261417(19756821(19)26)132022(28)2524(30)27(23(20)29)181115(2)1016(3)1218h1581014H9H223H3(H252830)b2013+
MFCD03711166
ZINC000001161050
ZINC01161050
ZINC1161050
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