Vitas-M small molecule compound
ethyl 4-({[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK765978
SMILES CCOC(=O)c1ccc(cc1)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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c1-3-29-20(28)13-8-10-14(11-9-13)22-17(27)12-30-21-23-19-18(24-25-21)15-6-4-5-7-16(15)26(19)2/h4-11H,3,12H2,1-2H3,(H,22,27)InChIKey
FIVXEDXPMJFFPE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3C)N=N2
ethyl4((((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC21H19N5O3Sc132920(28)1381014(11913)2217(27)123021231918(242521)15645716(15)26(19)2h411H312H212H3(H2227)
MFCD02934687
ZINC000001068459
ZINC01068459
ZINC1068459
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