Vitas-M small molecule compound

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[3-(propan-2-yloxy)phenyl]quinoline-4-carboxamide

Catalog ID
STK461278
SMILES N#Cc1c(sc2c1CCC2)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)OC(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 C27H23N3O2S MW 453.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O2S/c1-16(2)32-18-8-5-7-17(13-18)24-14-21(19-9-3-4-11-23(19)29-24)26(31)30-27-22(15-28)20-10-6-12-25(20)33-27/h3-5,7-9,11,13-14,16H,6,10,12H2,1-2H3,(H,30,31)
InChIKey
OPCYTSSQKBYENK-UHFFFAOYSA-N
Synonyms

CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCC5)C#N
InChI=1SC27H23N3O2Sc116(2)321885717(1318)241421(199341123(19)2924)26(31)302722(1528)201061225(20)3327h357911131416H61012H212H3(H3031)
MFCD05999991
N(3CYANO(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))(2(3(METHYLETHOXY)PHENYL)(4QUINOLYL))CARBOXAMIDE
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)2(3(propan2yloxy)phenyl)quinoline4carboxamide
N(3CYANO56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)2(3PROPAN2YLOXYPHENYL)QUINOLINE4CARBOXAMIDE
ZINC000002868173
ZINC02868173
ZINC2868173

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Available files

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