N-(3,5-dimethylphenyl)-2-(quinolin-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(quinolin-4-ylmethylsulfanyl)benzamide Openeye Name: N-(3,5-dimethylphenyl)-2-(4-quinolylmethylsulfanyl)benzamide CAS Name: N-(3,5-dimethylphenyl)-2-(4-quinolinylmethylthio)benzamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(quinolin-4-ylmethylsulfanyl)benzamide Traditional Name: N-(3,5-dimethylphenyl)-2-(4-quinolylmethylthio)benzamide Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=CC=CC=C2SCC3=CC=NC4=CC=CC=C34)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=CC=CC=C2SCC3=CC=NC4=CC=CC=C34)C

InChI

InChI=1S/C25H22N2OS/c1-17-13-18(2)15-20(14-17)27-25(28)22-8-4-6-10-24(22)29-16-19-11-12-26-23-9-5-3-7-21(19)23/h3-15H,16H2,1-2H3,(H,27,28)