Vitas-M small molecule compound
ethyl 4-({[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK777682
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc2c(n1)n(CC)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/c1-3-27-17-8-6-5-7-16(17)19-20(27)24-22(26-25-19)31-13-18(28)23-15-11-9-14(10-12-15)21(29)30-4-2/h5-12H,3-4,13H2,1-2H3,(H,23,28)InChIKey
YNUGUBVVQDXOMI-UHFFFAOYSA-NSynonyms
CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=CC=C(C=C4)C(=O)OCC
ethyl4((((5ethyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((5ETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC22H21N5O3Sc132717865716(17)1920(27)2422(262519)311318(28)231511914(101215)21(29)3042h512H3413H212H3(H2328)
MFCD05854830
ZINC000001425665
ZINC01425665
ZINC1425665
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