Vitas-M small molecule compound
2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}acetamide
Catalog ID
STK263627
SMILES Clc1ccc2c(c1)c(CCN/C(=N\C(=O)CSc1nnc([nH]1)N)/Nc1nc(C)cc(n1)C)c[nH]2
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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 C21H23ClN10OS MW 499.00 g/mol Purity >90% as per NMR
InChI
InChIKey
Synonyms
(3E)1(5AMINO(4H124TRIAZOL3YL)THIO)4((46DIMETHYLPYRIMIDIN2YL)AMINO)4((2(5CHLOROINDOL3YL)ETHYL)AMINO)3AZABUT3EN2ONE
2((5amino1H124triazol3yl)sulfanyl)N(N(2(5chloro1Hindol3yl)ethyl)N(46dimethylpyrimidin2yl)carbamimidoyl)acetamide
2((5amino4H124triazol3yl)sulfanyl)N((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)acetamide
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)CSC4=NNC(=N4)N)C
Clc1ccc2c(c1)c(CCNC(=NC(=O)CSc1nnc((nH)1)N)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC21H23ClN10OSc111712(2)2720(2611)3019(2817(33)1034212918(23)313221)246513925164314(22)815(13)16h347925H5610H212H3(H323293132)(H2242627283033)
MFCD08547042
ZINC000018088295
ZINC18088295
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