Vitas-M small molecule compound

3-chloro-N-(3,4-dihydroquinolin-1(2H)-ylcarbonothioyl)-6-methoxy-1-benzothiophene-2-carboxamide

Catalog ID
STL062558
SMILES COc1ccc2c(c1)sc(c2Cl)C(=O)NC(=S)N1CCCc2c1cccc2

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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 C20H17ClN2O2S2 MW 416.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O2S2/c1-25-13-8-9-14-16(11-13)27-18(17(14)21)19(24)22-20(26)23-10-4-6-12-5-2-3-7-15(12)23/h2-3,5,7-9,11H,4,6,10H2,1H3,(H,22,24,26)
InChIKey
QXYNYLUCJZRCNF-UHFFFAOYSA-N
Synonyms

3CHLORON(34DIHYDRO1(2H)QUINOLINYLCARBOTHIOYL)6METHOXY1BENZOTHIOPHENE2CARBOXAMIDE
3CHLORON(34DIHYDRO2HQUINOLINE1CARBOTHIOYL)6METHOXY1BENZOTHIOPHENE2CARBOXAMIDE
3chloroN(34dihydroquinolin1(2H)ylcarbonothioyl)6methoxy1benzothiophene2carboxamide
3CHLORON(34DIHYDROQUINOLIN1(2H)YLCARBOTHIOYL)6METHOXY1BENZOTHIOPHENE2CARBOXAMIDE
COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)N3CCCC4=CC=CC=C43)Cl
InChI=1SC20H17ClN2O2S2c12513891416(1113)2718(17(14)21)19(24)2220(26)23104612523715(12)23h2357911H4610H21H3(H222426)
MFCD03590208
ZINC000001129093
ZINC01129093
ZINC1129093

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Available files

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