Vitas-M small molecule compound
ethyl 2-{[3-({[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]sulfonyl}amino)quinoxalin-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK538664
SMILES CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)n2nc(cc2C)C)sc2c1CCCC2
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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 C30H30N6O4S2 MW 602.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N6O4S2/c1-4-40-30(37)26-22-9-5-8-12-25(22)41-29(26)33-27-28(32-24-11-7-6-10-23(24)31-27)35-42(38,39)21-15-13-20(14-16-21)36-19(3)17-18(2)34-36/h6-7,10-11,13-17H,4-5,8-9,12H2,1-3H3,(H,31,33)(H,32,35)InChIKey
QBCPJWTXYQGAFW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(C=C5)N6C(=CC(=N6)C)C
ethyl2((3(((4(35dimethyl1Hpyrazol1yl)phenyl)sulfonyl)amino)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3((4(35dimethylpyrazol1yl)phenyl)sulfonylamino)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3(4(35dimethyl1Hpyrazol1yl)phenylsulfonamido)quinoxalin2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC30H30N6O4S2c144030(37)26229581225(22)4129(26)332728(322411761023(24)3127)3542(3839)21151320(141621)3619(3)1718(2)3436h6710111317H458912H213H3(H3133)(H3235)
MFCD03289668
ZINC000102186393
ZINC102186393
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