Vitas-M small molecule compound
2-(3-butoxyphenyl)-N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide
Catalog ID
STK428672
SMILES CCCCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc(c(c1C#N)c1ccc(cc1)OC)C
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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 C33H29N3O3S MW 547.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3O3S/c1-4-5-17-39-25-10-8-9-23(18-25)30-19-27(26-11-6-7-12-29(26)35-30)32(37)36-33-28(20-34)31(21(2)40-33)22-13-15-24(38-3)16-14-22/h6-16,18-19H,4-5,17H2,1-3H3,(H,36,37)InChIKey
HQKKWHIBSRWMDP-UHFFFAOYSA-NSynonyms
(2(3BUTOXYPHENYL)(4QUINOLYL))N(3CYANO4(4METHOXYPHENYL)5METHYL(2THIENYL))CARBOXAMIDE
2(3BUTOXYPHENYL)N(3CYANO4(4METHOXYPHENYL)5METHYL2THIENYL)4QUINOLINECARBOXAMIDE
2(3butoxyphenyl)N(3cyano4(4methoxyphenyl)5methylthiophen2yl)quinoline4carboxamide
CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)OC)C#N
InChI=1SC33H29N3O3Sc145173925108923(1825)301927(2611671229(26)3530)32(37)363328(2034)31(21(2)4033)22131524(383)161422h6161819H4517H213H3(H3637)
MFCD03233280
ZINC000002789311
ZINC02789311
ZINC2789311
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