Vitas-M small molecule compound

N-(5-benzyl-3-carbamoylthiophen-2-yl)-2-(3-butoxyphenyl)quinoline-4-carboxamide

Catalog ID
STK428582
SMILES CCCCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc(cc1C(=O)N)Cc1ccccc1

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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 C32H29N3O3S MW 535.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O3S/c1-2-3-16-38-23-13-9-12-22(18-23)29-20-26(25-14-7-8-15-28(25)34-29)31(37)35-32-27(30(33)36)19-24(39-32)17-21-10-5-4-6-11-21/h4-15,18-20H,2-3,16-17H2,1H3,(H2,33,36)(H,35,37)
InChIKey
ZGZZONJEJSVROU-UHFFFAOYSA-N
Synonyms

2((2(3BUTOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)5BENZYLTHIOPHENE3CARBOXAMIDE
CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(S4)CC5=CC=CC=C5)C(=O)N
InChI=1SC32H29N3O3Sc1231638231391222(1823)292026(2514781528(25)3429)31(37)353227(30(33)36)1924(3932)1721105461121h4151820H231617H21H3(H23336)(H3537)
MFCD03233278
N(3(AMINOCARBONYL)5BENZYL2THIENYL)2(3BUTOXYPHENYL)4QUINOLINECARBOXAMIDE
N(5benzyl3carbamoylthiophen2yl)2(3butoxyphenyl)quinoline4carboxamide
ZINC000002789308
ZINC02789308
ZINC2789308

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.