Vitas-M small molecule compound
propyl 2-({[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418239
SMILES CCCOC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(c(c2)C)C)sc2c1CCC(C2)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/c1-5-14-36-31(35)28-23-13-10-18(2)15-27(23)37-30(28)33-29(34)24-17-26(21-12-11-19(3)20(4)16-21)32-25-9-7-6-8-22(24)25/h6-9,11-12,16-18H,5,10,13-15H2,1-4H3,(H,33,34)InChIKey
YXHGYWQGNORHHB-UHFFFAOYSA-NSynonyms
438617-09-5438617095
CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)C)C
InChI=1SC31H32N2O3Sc15143631(35)2823131018(2)1527(23)3730(28)3329(34)241726(21121119(3)20(4)1621)3225976822(24)25h6911121618H5101315H214H3(H3334)
MFCD01919736
propyl2(((2(34dimethylphenyl)quinolin4yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propyl2((2(34dimethylphenyl)quinoline4carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ZINC000002084753
ZINC000002084754
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