Vitas-M small molecule compound
N-[2-(2-{(Z)-[1-(4-fluorobenzyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]propanamide
Catalog ID
STL042330
SMILES CCC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)Cc2ccc(cc2)F)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 C25H23FN4O3S MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23FN4O3S/c1-2-22(31)27-12-11-18-17-5-3-4-6-20(17)28-21(18)13-19-23(32)29-25(34)30(24(19)33)14-15-7-9-16(26)10-8-15/h3-10,13,28H,2,11-12,14H2,1H3,(H,27,31)(H,29,32,34)/b19-13-InChIKey
RJCIAAGCGAPCEM-UYRXBGFRSA-NSynonyms
CCC(=O)NCCC1=C(NC2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)CC4=CC=C(C=C4)F
CCC(=O)NCCc1c(C=C2C(=O)N=C(N(C2=O)Cc2ccc(cc2)F)S)(nH)c2c1cccc2
InChI=1SC25H23FN4O3Sc1222(31)2712111817534620(17)2821(18)131923(32)2925(34)30(24(19)33)14157916(26)10815h3101328H2111214H21H3(H2731)(H293234)b1913
MFCD05734926
N(2(2((Z)(1((4FLUOROPHENYL)METHYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)1HINDOL3YL)ETHYL)PROPANAMIDE
N(2(2((Z)(1(4fluorobenzyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol3yl)ethyl)propanamide
ZINC000017251489
ZINC17251489
Check stock
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Check stock on Vitas-MAvailable files
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