Vitas-M small molecule compound
ethyl 4-[(2-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-3-[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]acryloyl)amino]benzoate
Catalog ID
STK823507
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=C(/C(=O)Nc1ccc(cc1)C(=O)OCC)\C(=O)Nc1ccc(cc1)C(=O)OCC)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 C41H40N4O7 MW 700.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H40N4O7/c1-5-23-52-36-22-17-30(24-27(36)4)37-31(26-45(44-37)34-11-9-8-10-12-34)25-35(38(46)42-32-18-13-28(14-19-32)40(48)50-6-2)39(47)43-33-20-15-29(16-21-33)41(49)51-7-3/h8-22,24-26H,5-7,23H2,1-4H3,(H,42,46)(H,43,47)InChIKey
DNHSBKNBQIWUGR-UHFFFAOYSA-NSynonyms
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C(=O)NC3=CC=C(C=C3)C(=O)OCC)C(=O)NC4=CC=C(C=C4)C(=O)OCC)C5=CC=CC=C5)C
CCCOc1ccc(cc1C)c1nn(cc1C=C(C(=O)Nc1ccc(cc1)C(=O)OCC)C(=O)Nc1ccc(cc1)C(=O)OCC)c1ccccc1
ethyl4((2((4(ethoxycarbonyl)phenyl)carbamoyl)3(3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)acryloyl)amino)benzoate
ethyl4((2((4ethoxycarbonylphenyl)carbamoyl)3(3(3methyl4propoxyphenyl)1phenylpyrazol4yl)prop2enoyl)amino)benzoate
InChI=1SC41H40N4O7c15235236221730(2427(36)4)3731(2645(4437)341198101234)2535(38(46)4232181328(141932)40(48)5062)39(47)4333201529(162133)41(49)5173h8222426H5723H214H3(H4246)(H4347)
MFCD03464008
ZINC000150481112
ZINC150481112
Check stock
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Check stock on Vitas-MAvailable files
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