Vitas-M small molecule compound
N-[2-(2-{(Z)-[1-(3-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]propanamide
Catalog ID
STL039210
SMILES CCC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2cccc(c2)C)S)[nH]c2c1cccc2
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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 C25H24N4O3S MW 460.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S/c1-3-22(30)26-12-11-18-17-9-4-5-10-20(17)27-21(18)14-19-23(31)28-25(33)29(24(19)32)16-8-6-7-15(2)13-16/h4-10,13-14,27H,3,11-12H2,1-2H3,(H,26,30)(H,28,31,33)/b19-14-InChIKey
GHKSEZBULLTPCW-RGEXLXHISA-NSynonyms
CCC(=O)NCCC1=C(NC2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C
CCC(=O)NCCc1c(C=C2C(=O)N=C(N(C2=O)c2cccc(c2)C)S)(nH)c2c1cccc2
InChI=1SC25H24N4O3Sc1322(30)26121118179451020(17)2721(18)141923(31)2825(33)29(24(19)32)1686715(2)1316h410131427H31112H212H3(H2630)(H283133)b1914
MFCD04076328
N(2(2((Z)(1(3methylphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol3yl)ethyl)propanamide
N(2(2((Z)(1(3METHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)1HINDOL3YL)ETHYL)PROPANAMIDE
ZINC000001264653
ZINC01264653
ZINC1264653
ZINC13777298
Check stock
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Check stock on Vitas-MAvailable files
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