Vitas-M small molecule compound
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-[3-(propan-2-yloxy)phenyl]quinoline-4-carboxamide
Catalog ID
STK317768
SMILES N#Cc1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OC(C)C)sc2c1CCCC2
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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 C29H26N4O2S2 MW 526.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O2S2/c1-17(2)35-19-9-7-8-18(14-19)25-15-22(20-10-3-5-12-24(20)31-25)27(34)32-29(36)33-28-23(16-30)21-11-4-6-13-26(21)37-28/h3,5,7-10,12,14-15,17H,4,6,11,13H2,1-2H3,(H2,32,33,34,36)InChIKey
CZGPRKPXSMOLDA-UHFFFAOYSA-NSynonyms
445237-81-0445237810
CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=C(C5=C(S4)CCCC5)C#N
InChI=1SC29H26N4O2S2c117(2)351997818(1419)251522(2010351224(20)3125)27(34)3229(36)332823(1630)2111461326(21)3728h3571012141517H461113H212H3(H232333436)
MFCD02609251
N((3cyano4567tetrahydro1benzothiophen2yl)carbamothioyl)2(3(propan2yloxy)phenyl)quinoline4carboxamide
N((3cyano4567tetrahydro1benzothiophen2yl)carbamothioyl)2(3propan2yloxyphenyl)quinoline4carboxamide
ZINC000002108677
ZINC02108677
ZINC2108677
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