Vitas-M small molecule compound
methyl 2-({[8-chloro-2-(pyridin-2-yl)quinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK444400
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc(nc2c1cccc2Cl)c1ccccn1
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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 C27H24ClN3O3S MW 506.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN3O3S/c1-3-15-10-11-17-22(13-15)35-26(23(17)27(33)34-2)31-25(32)18-14-21(20-9-4-5-12-29-20)30-24-16(18)7-6-8-19(24)28/h4-9,12,14-15H,3,10-11,13H2,1-2H3,(H,31,32)InChIKey
IYRKQOHMIIVEJA-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CC=CC=N5
InChI=1SC27H24ClN3O3Sc131510111722(1315)3526(23(17)27(33)342)3125(32)181421(20945122920)302416(18)76819(24)28h49121415H3101113H212H3(H3132)
methyl2(((8chloro2(pyridin2yl)quinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl2((8chloro2pyridin2ylquinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
MFCD04055550
ZINC000020563059
ZINC000020563062
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