Vitas-M small molecule compound
N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide
Catalog ID
STK427871
SMILES CCc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C#N)CCC(C2)C(CC)(C)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 C32H33N3OS MW 507.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3OS/c1-5-20-11-13-21(14-12-20)28-18-25(23-9-7-8-10-27(23)34-28)30(36)35-31-26(19-33)24-16-15-22(17-29(24)37-31)32(3,4)6-2/h7-14,18,22H,5-6,15-17H2,1-4H3,(H,35,36)InChIKey
OQTJXTDLERCXBH-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)CC)C#N
InChI=1SC32H33N3OSc1520111321(141220)281825(239781027(23)3428)30(36)353126(1933)24161522(1729(24)3731)32(34)62h7141822H561517H214H3(H3536)
MFCD01349680
N(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)2(4ethylphenyl)quinoline4carboxamide
ZINC000002738868
ZINC000002738869
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