Vitas-M small molecule compound
methyl S-benzyl-N-{[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}cysteinate
Catalog ID
STK779952
SMILES COC(=O)C(NC(=O)CSc1nnc2c(n1)n(CC)c1c2cccc1)CSCc1ccccc1
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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 C24H25N5O3S2 MW 495.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O3S2/c1-3-29-19-12-8-7-11-17(19)21-22(29)26-24(28-27-21)34-15-20(30)25-18(23(31)32-2)14-33-13-16-9-5-4-6-10-16/h4-12,18H,3,13-15H2,1-2H3,(H,25,30)InChIKey
JPMLGWUIMMQKHJ-UHFFFAOYSA-NSynonyms
CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC(CSCC4=CC=CC=C4)C(=O)OC
InChI=1SC24H25N5O3S2c13291912871117(19)2122(29)2624(282721)341520(30)2518(23(31)322)1433131695461016h41218H31315H212H3(H2530)
METHYL3BENZYLSULFANYL2((2((5ETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)PROPANOATE
methylSbenzylN(((5ethyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)cysteinate
MFCD05859539
ZINC000012413783
ZINC000012413785
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