Vitas-M small molecule compound
methyl 6-methyl-2-({[2-(4-propoxyphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK423633
SMILES CCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)OC)CCC(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 C30H30N2O4S MW 514.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O4S/c1-4-15-36-20-12-10-19(11-13-20)25-17-23(21-7-5-6-8-24(21)31-25)28(33)32-29-27(30(34)35-3)22-14-9-18(2)16-26(22)37-29/h5-8,10-13,17-18H,4,9,14-16H2,1-3H3,(H,32,33)InChIKey
JDKYKILVJKJINU-UHFFFAOYSA-NSynonyms
CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CC(CC5)C)C(=O)OC
InChI=1SC30H30N2O4Sc14153620121019(111320)251723(21756824(21)3125)28(33)322927(30(34)353)2214918(2)1626(22)3729h5810131718H491416H213H3(H3233)
methyl6methyl2(((2(4propoxyphenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6methyl2((2(4propoxyphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01923086
ZINC000002754106
ZINC000002754107
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