4-[2-(2-dimethylaminoethylsulfanyl)quinolin-3-yl]benzamide

Systemtic Name: 4-[2-(2-dimethylaminoethylsulfanyl)quinolin-3-yl]benzamide Openeye Name: 4-[2-(2-dimethylaminoethylsulfanyl)-3-quinolyl]benzamide CAS Name: 4-[2-(2-dimethylaminoethylthio)-3-quinolinyl]benzamide IUPAC Name: 4-[2-(2-dimethylaminoethylsulfanyl)quinolin-3-yl]benzamide Traditional Name: 4-[2-(2-dimethylaminoethylthio)-3-quinolyl]benzamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=CC=CC=C2C=C1C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CN(C)CCSC1=NC2=CC=CC=C2C=C1C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H21N3OS/c1-23(2)11-12-25-20-17(13-16-5-3-4-6-18(16)22-20)14-7-9-15(10-8-14)19(21)24/h3-10,13H,11-12H2,1-2H3,(H2,21,24)