Vitas-M small molecule compound
propan-2-yl 2-{[(6-chloro-2-phenylquinolin-4-yl)carbonyl]amino}-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK434382
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC(C)C)NC(=O)c1cc(nc2c1cc(Cl)cc2)c1ccccc1
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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 C30H29ClN2O3S MW 533.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29ClN2O3S/c1-4-18-10-12-21-26(14-18)37-29(27(21)30(35)36-17(2)3)33-28(34)23-16-25(19-8-6-5-7-9-19)32-24-13-11-20(31)15-22(23)24/h5-9,11,13,15-18H,4,10,12,14H2,1-3H3,(H,33,34)InChIKey
DCIWTZXTFNMBCS-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC30H29ClN2O3Sc141810122126(1418)3729(27(21)30(35)3617(2)3)3328(34)231625(198657919)3224131120(31)1522(23)24h5911131518H4101214H213H3(H3334)
MFCD03942597
propan2yl2(((6chloro2phenylquinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
propan2yl2((6chloro2phenylquinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
ZINC000097945643
ZINC000097945644
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