2-quinolin-8-ylsulfanyl-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]ethanamide

Systemtic Name: 2-quinolin-8-ylsulfanyl-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]ethanamide Openeye Name: 2-(8-quinolylsulfanyl)-N-[(Z)-(2,4,5-trimethoxyphenyl)methyleneamino]acetamide CAS Name: 2-(8-quinolinylthio)-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-quinolin-8-ylsulfanyl-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(8-quinolylthio)-N-[(Z)-(2,4,5-trimethoxybenzylidene)amino]acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=NNC(=O)CSC2=CC=CC3=C2N=CC=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=N\NC(=O)CSC2=CC=CC3=C2N=CC=C3)OC)OC

InChI

InChI=1S/C21H21N3O4S/c1-26-16-11-18(28-3)17(27-2)10-15(16)12-23-24-20(25)13-29-19-8-4-6-14-7-5-9-22-21(14)19/h4-12H,13H2,1-3H3,(H,24,25)/b23-12-