Vitas-M small molecule compound
2-({[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK246842
SMILES O=C(Nc1sc2c(c1C(=O)N)CCCC2)CSc1nnc2c(n1)n(C)c1c2cccc1
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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 C21H20N6O2S2 MW 452.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O2S2/c1-27-13-8-4-2-6-11(13)17-19(27)24-21(26-25-17)30-10-15(28)23-20-16(18(22)29)12-7-3-5-9-14(12)31-20/h2,4,6,8H,3,5,7,9-10H2,1H3,(H2,22,29)(H,23,28)InChIKey
VJRXKHMXXZGBOA-UHFFFAOYSA-NSynonyms
891476-70-32((((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((2((5methyl(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
891476703
CN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=C(C5=C(S4)CCCC5)C(=O)N
InChI=1SC21H20N6O2S2c12713842611(13)1719(27)2421(262517)301015(28)232016(18(22)29)12735914(12)3120h2468H357910H21H3(H22229)(H2328)
MFCD07130321
ZINC000009668855
ZINC09668855
ZINC9668855
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