Vitas-M small molecule compound
N-{4-[4-(butan-2-yl)phenyl]-3-cyano-5-methylthiophen-2-yl}-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
Catalog ID
STK428789
SMILES N#Cc1c(sc(c1c1ccc(cc1)C(CC)C)C)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)OCC(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 C36H35N3O2S MW 573.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H35N3O2S/c1-6-23(4)25-14-16-26(17-15-25)34-24(5)42-36(31(34)20-37)39-35(40)30-19-33(38-32-13-8-7-12-29(30)32)27-10-9-11-28(18-27)41-21-22(2)3/h7-19,22-23H,6,21H2,1-5H3,(H,39,40)InChIKey
HNVQLEBTZWFSNR-UHFFFAOYSA-NSynonyms
CCC(C)C1=CC=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OCC(C)C)C
InChI=1SC36H35N3O2Sc1623(4)25141626(171525)3424(5)4236(31(34)2037)3935(40)301933(383213871229(30)32)271091128(1827)412122(2)3h7192223H621H215H3(H3940)
MFCD03233956
N(3CYANO5METHYL4(4(METHYLPROPYL)PHENYL)(2THIENYL))(2(3(2METHYLPROPOXY)PHENYL)(4QUINOLYL))CARBOXAMIDE
N(4(4(butan2yl)phenyl)3cyano5methylthiophen2yl)2(3(2methylpropoxy)phenyl)quinoline4carboxamide
N(4(4BUTAN2YLPHENYL)3CYANO5METHYLTHIOPHEN2YL)2(3(2METHYLPROPOXY)PHENYL)QUINOLINE4CARBOXAMIDE
N(4(4SECBUTYLPHENYL)3CYANO5METHYL2THIENYL)2(3ISOBUTOXYPHENYL)4QUINOLINECARBOXAMIDE
ZINC000002108302
ZINC000002108304
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