Vitas-M small molecule compound

[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl][3-(morpholin-4-ylsulfonyl)phenyl]methanone

Catalog ID
STK551396
SMILES CCOc1cc2c(cc1OCC)CCN(C2Cc1ccc(c(c1)OCC)OCC)C(=O)c1cccc(c1)S(=O)(=O)N1CCOCC1

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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 C35H44N2O8S MW 652.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H44N2O8S/c1-5-42-31-13-12-25(21-32(31)43-6-2)20-30-29-24-34(45-8-4)33(44-7-3)23-26(29)14-15-37(30)35(38)27-10-9-11-28(22-27)46(39,40)36-16-18-41-19-17-36/h9-13,21-24,30H,5-8,14-20H2,1-4H3
InChIKey
FAURJYRQBGLAEZ-UHFFFAOYSA-N
Synonyms

(1((34DIETHOXYPHENYL)METHYL)67DIETHOXY34DIHYDRO1HISOQUINOLIN2YL)(3MORPHOLIN4YLSULFONYLPHENYL)METHANONE
(1(34diethoxybenzyl)67diethoxy34dihydroisoquinolin2(1H)yl)(3(morpholin4ylsulfonyl)phenyl)methanone
(1(34diethoxybenzyl)67diethoxy34dihydroisoquinolin2(1H)yl)(3(morpholinosulfonyl)phenyl)methanone
CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5)OCC)OCC)OCC
InChI=1SC35H44N2O8Sc154231131225(2132(31)4362)2030292434(4584)33(4473)2326(29)141537(30)35(38)271091128(2227)46(3940)36161841191736h913212430H581420H214H3
MFCD03678812
ZINC000150435908
ZINC000150435911

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Available files

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