Vitas-M small molecule compound
ethyl 2-({[2-(3-ethoxyphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Catalog ID
STK419689
SMILES CCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)OCC)CCCCCCCCCC2
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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 C35H40N2O4S MW 584.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N2O4S/c1-3-40-25-17-15-16-24(22-25)30-23-28(26-18-13-14-20-29(26)36-30)33(38)37-34-32(35(39)41-4-2)27-19-11-9-7-5-6-8-10-12-21-31(27)42-34/h13-18,20,22-23H,3-12,19,21H2,1-2H3,(H,37,38)InChIKey
WFYZMNMXYPVQMZ-UHFFFAOYSA-NSynonyms
350998-10-6350998106
CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCCCCCCCCC5)C(=O)OCC
ethyl2(((2(3ethoxyphenyl)quinolin4yl)carbonyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
ethyl2((2(3ethoxyphenyl)quinoline4carbonyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
InChI=1SC35H40N2O4Sc13402517151624(2225)302328(261813142029(26)3630)33(38)373432(35(39)4142)2719119756810122131(27)4234h1318202223H3121921H212H3(H3738)
MFCD01922564
ZINC000008444008
ZINC08444008
ZINC8444008
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