Vitas-M small molecule compound
methyl N-{(E)-[1-(2,5-dimethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}tryptophanate
Catalog ID
STK596407
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)c1cc(OC)ccc1OC)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 C25H24N4O6S MW 508.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O6S/c1-33-15-8-9-21(34-2)20(11-15)29-23(31)17(22(30)28-25(29)36)13-27-19(24(32)35-3)10-14-12-26-18-7-5-4-6-16(14)18/h4-9,11-13,19,26-27H,10H2,1-3H3,(H,28,30,36)/b17-13+InChIKey
RMJJGJQQXXAXLZ-GHRIWEEISA-NSynonyms
COC(=O)C(Cc1c(nH)c2c1cccc2)NC=C1C(=O)N=C(N(C1=O)c1cc(OC)ccc1OC)S
COC1=CC(=C(C=C1)OC)N2C(=O)C(=CNC(CC3=CNC4=CC=CC=C43)C(=O)OC)C(=O)NC2=S
InChI=1SC25H24N4O6Sc133158921(342)20(1115)2923(31)17(22(30)2825(29)36)132719(24(32)353)1014122618754616(14)18h491113192627H10H213H3(H283036)b1713+
METHYL2(((E)(1(25DIMETHOXYPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)AMINO)3(1HINDOL3YL)PROPANOATE
methylN((E)(1(25dimethoxyphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)tryptophanate
MFCD07201619
ZINC000002264608
ZINC000002264610
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