Vitas-M small molecule compound
propan-2-yl 2-({[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK442098
SMILES CC1CCc2c(C1)sc(c2C(=O)OC(C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1C)C
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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 C31H32N2O3S MW 512.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O3S/c1-17(2)36-31(35)28-23-13-11-19(4)15-27(23)37-30(28)33-29(34)24-16-26(21-12-10-18(3)14-20(21)5)32-25-9-7-6-8-22(24)25/h6-10,12,14,16-17,19H,11,13,15H2,1-5H3,(H,33,34)InChIKey
UVLKTEJAVDWYAD-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(C=C(C=C5)C)C
InChI=1SC31H32N2O3Sc117(2)3631(35)2823131119(4)1527(23)3730(28)3329(34)241626(21121018(3)1420(21)5)3225976822(24)25h6101214161719H111315H215H3(H3334)
MFCD01343200
propan2yl2(((2(24dimethylphenyl)quinolin4yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propan2yl2((2(24dimethylphenyl)quinoline4carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ZINC000002737419
ZINC000002737420
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