Vitas-M small molecule compound
methyl N-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}phenylalaninate
Catalog ID
STK119935
SMILES COC(=O)C(Cc1ccccc1)NC(=O)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 C22H21N5O3S MW 435.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O3S/c1-27-17-11-7-6-10-15(17)19-20(27)24-22(26-25-19)31-13-18(28)23-16(21(29)30-2)12-14-8-4-3-5-9-14/h3-11,16H,12-13H2,1-2H3,(H,23,28)InChIKey
CONHQVGVVDODRU-UHFFFAOYSA-NSynonyms
1027305-21-01027305210
CN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC(CC4=CC=CC=C4)C(=O)OC
InChI=1SC22H21N5O3Sc1271711761015(17)1920(27)2422(262519)311318(28)2316(21(29)302)12148435914h31116H1213H212H3(H2328)
METHYL2((2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)3PHENYLPROPANOATE
METHYLN(((5METHYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)PHENYLALANINATE
MFCD04128750
ZINC000002481299
ZINC000002481300
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