Vitas-M small molecule compound
ethyl 4-[({[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK765206
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc2c(n1)n(CCc1ccccc1)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 C28H25N5O3S MW 511.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O3S/c1-2-36-27(35)20-12-14-21(15-13-20)29-24(34)18-37-28-30-26-25(31-32-28)22-10-6-7-11-23(22)33(26)17-16-19-8-4-3-5-9-19/h3-15H,2,16-18H2,1H3,(H,29,34)InChIKey
UXSOFRCBIRXUBW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3CCC5=CC=CC=C5)N=N2
ethyl4((((5(2phenylethyl)5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)benzoate
ethyl4((2((5(2phenylethyl)(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((5PHENETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC28H25N5O3Sc123627(35)20121421(151320)2924(34)183728302625(313228)2210671123(22)33(26)1716198435919h315H21618H21H3(H2934)
MFCD02933556
ZINC000000718004
ZINC00718004
ZINC718004
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