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

Systemtic Name: 4-[2-(2-dimethylaminoethylsulfanyl)quinolin-3-yl]-N,N-dimethyl-benzamide Openeye Name: 4-[2-(2-dimethylaminoethylsulfanyl)-3-quinolyl]-N,N-dimethyl-benzamide CAS Name: 4-[2-(2-dimethylaminoethylthio)-3-quinolinyl]-N,N-dimethylbenzamide IUPAC Name: 4-[2-(2-dimethylaminoethylsulfanyl)quinolin-3-yl]-N,N-dimethylbenzamide Traditional Name: 4-[2-(2-dimethylaminoethylthio)-3-quinolyl]-N,N-dimethyl-benzamide Formula: C22H25N3OS MolecularWeight: 379.5184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3OS/c1-24(2)13-14-27-21-19(15-18-7-5-6-8-20(18)23-21)16-9-11-17(12-10-16)22(26)25(3)4/h5-12,15H,13-14H2,1-4H3