Vitas-M small molecule compound
ethyl 1-phenyl-5-({[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)-1H-pyrazole-4-carboxylate
Catalog ID
STK675147
SMILES CCOC(=O)c1cnn(c1NC(=O)CSc1nnc2c(n1)n(CCC)c1c2cccc1)c1ccccc1
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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 C26H25N7O3S MW 515.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N7O3S/c1-3-14-32-20-13-9-8-12-18(20)22-24(32)29-26(31-30-22)37-16-21(34)28-23-19(25(35)36-4-2)15-27-33(23)17-10-6-5-7-11-17/h5-13,15H,3-4,14,16H2,1-2H3,(H,28,34)InChIKey
CGOHYVRSCIYDMD-UHFFFAOYSA-NSynonyms
CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=C(C=NN4C5=CC=CC=C5)C(=O)OCC
ethyl1phenyl5((((5propyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)1Hpyrazole4carboxylate
ETHYL1PHENYL5((2((5PROPYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)PYRAZOLE4CARBOXYLATE
InChI=1SC26H25N7O3Sc1314322013981218(20)2224(32)2926(313022)371621(34)282319(25(35)3642)152733(23)17106571117h51315H341416H212H3(H2834)
MFCD01572799
ZINC000008443769
ZINC08443769
ZINC8443769
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