Vitas-M small molecule compound

ethyl [5-({2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanoyl}amino)-1,3,4-thiadiazol-2-yl]acetate

Catalog ID
STK720088
SMILES CCOC(=O)Cc1nnc(s1)NC(=O)C(Sc1nnc2c(n1)n(C)c1c2cccc1)CC

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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 C20H21N7O3S2 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N7O3S2/c1-4-13(18(29)22-20-25-23-14(32-20)10-15(28)30-5-2)31-19-21-17-16(24-26-19)11-8-6-7-9-12(11)27(17)3/h6-9,13H,4-5,10H2,1-3H3,(H,22,25,29)
InChIKey
XICNUUJMMQQYKH-UHFFFAOYSA-N
Synonyms
682759-79-1
2(5((2((5METHYL(124)TRIAZINO(56B)INDOL3YL)THIO)1OXOBUTYL)AMINO)134THIADIAZOL2YL)ACETICACIDETHYLESTER
2(5(2((5METHYL(124)TRIAZIN(56B)INDOL3YL)THIO)BUTANOYLAMINO)134THIADIAZOL2YL)ACETICACIDETHYLESTER
682759791
CCC(C(=O)NC1=NN=C(S1)CC(=O)OCC)SC2=NC3=C(C4=CC=CC=C4N3C)N=N2
ethyl(5((2((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)butanoyl)amino)134thiadiazol2yl)acetate
ETHYL(5((2((5METHYL5H(124)TRIAZINO(56B)INDOL3YL)THIO)BUTANOYL)AMINO)134THIADIAZOL2YL)ACETATE
ETHYL2(5(2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTANOYLAMINO)134THIADIAZOL2YL)ACETATE
ETHYL2(5(2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTANOYLAMINO)134THIADIAZOL2YL)ETHANOATE
InChI=1SC20H21N7O3S2c1413(18(29)2220252314(3220)1015(28)3052)3119211716(242619)11867912(11)27(17)3h6913H4510H213H3(H222529)
MFCD03767008
ZINC000002751055
ZINC000002751056

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Available files

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