Vitas-M small molecule compound

2-(4-ethoxyphenyl)-N-[2-(4-{[2-(4-ethoxyphenyl)quinolin-4-yl]carbonyl}piperazin-1-yl)ethyl]quinoline-4-carboxamide

Catalog ID
STK433392
SMILES CCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)NCCN1CCN(CC1)C(=O)c1cc(nc2c1cccc2)c1ccc(cc1)OCC

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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 C42H41N5O4 MW 679.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H41N5O4/c1-3-50-31-17-13-29(14-18-31)39-27-35(33-9-5-7-11-37(33)44-39)41(48)43-21-22-46-23-25-47(26-24-46)42(49)36-28-40(45-38-12-8-6-10-34(36)38)30-15-19-32(20-16-30)51-4-2/h5-20,27-28H,3-4,21-26H2,1-2H3,(H,43,48)
InChIKey
POKWAZYMDPFHBK-UHFFFAOYSA-N
Synonyms

(2(4ETHOXYPHENYL)(4QUINOLYL))N(2(4((2(4ETHOXYPHENYL)(4QUINOLYL))CARBONYL)PIPERAZINYL)ETHYL)CARBOXAMIDE
2(4ETHOXYPHENYL)N(2(4((2(4ETHOXYPHENYL)4QUINOLINYL)CARBONYL)1PIPERAZINYL)ETHYL)4QUINOLINECARBOXAMIDE
2(4ethoxyphenyl)N(2(4((2(4ethoxyphenyl)quinolin4yl)carbonyl)piperazin1yl)ethyl)quinoline4carboxamide
2(4ETHOXYPHENYL)N(2(4(2(4ETHOXYPHENYL)QUINOLINE4CARBONYL)PIPERAZIN1YL)ETHYL)QUINOLINE4CARBOXAMIDE
CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCN4CCN(CC4)C(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)OCC
InChI=1SC42H41N5O4c135031171329(141831)392735(339571137(33)4439)41(48)43212246232547(262446)42(49)362840(453812861034(36)38)30151932(201630)5142h5202728H342126H212H3(H4348)
MFCD03402866
ZINC000035999813
ZINC35999813

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Available files

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