Vitas-M small molecule compound
ethyl 2-{[(6-chloro-2-phenylquinolin-4-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK434287
SMILES CCOC(=O)c1c(NC(=O)c2cc(nc3c2cc(Cl)cc3)c2ccccc2)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 C28H25ClN2O3S MW 505.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN2O3S/c1-3-34-28(33)25-19-11-9-16(2)13-24(19)35-27(25)31-26(32)21-15-23(17-7-5-4-6-8-17)30-22-12-10-18(29)14-20(21)22/h4-8,10,12,14-16H,3,9,11,13H2,1-2H3,(H,31,32)InChIKey
OTTLSJLCBIOXLJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=CC=C5
ethyl2(((6chloro2phenylquinolin4yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((6chloro2phenylquinoline4carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC28H25ClN2O3Sc133428(33)251911916(2)1324(19)3527(25)3126(32)211523(177546817)3022121018(29)1420(21)22h4810121416H391113H212H3(H3132)
MFCD03942605
ZINC000020168401
ZINC000020168403
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