Vitas-M small molecule compound
methyl 2-({[2-(3-ethoxyphenyl)quinolin-4-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK423613
SMILES CCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)OC)CCCCC2
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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 C29H28N2O4S MW 500.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O4S/c1-3-35-19-11-9-10-18(16-19)24-17-22(20-12-7-8-14-23(20)30-24)27(32)31-28-26(29(33)34-2)21-13-5-4-6-15-25(21)36-28/h7-12,14,16-17H,3-6,13,15H2,1-2H3,(H,31,32)InChIKey
LZDPBMSJPXLCGY-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)OC
InChI=1SC29H28N2O4Sc1335191191018(1619)241722(2012781423(20)3024)27(32)312826(29(33)342)21135461525(21)3628h712141617H361315H212H3(H3132)
methyl2(((2(3ethoxyphenyl)quinolin4yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2(3ethoxyphenyl)quinoline4carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01922709
ZINC000002753604
ZINC02753604
ZINC2753604
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