Vitas-M small molecule compound
ethyl 2-({[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418241
SMILES CCOC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(c(c2)C)C)sc2c1CCC(C2)CC
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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/c1-5-20-12-14-23-27(16-20)37-30(28(23)31(35)36-6-2)33-29(34)24-17-26(21-13-11-18(3)19(4)15-21)32-25-10-8-7-9-22(24)25/h7-11,13,15,17,20H,5-6,12,14,16H2,1-4H3,(H,33,34)InChIKey
FHVAGCUZWOXABP-UHFFFAOYSA-NSynonyms
438617-21-1438617211
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)C)C
ethyl2(((2(34dimethylphenyl)quinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(34dimethylphenyl)quinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC31H32N2O3Sc152012142327(1620)3730(28(23)31(35)3662)3329(34)241726(21131118(3)19(4)1521)32251087922(24)25h71113151720H56121416H214H3(H3334)
MFCD01919761
ZINC000002084759
ZINC000002084760
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