N-[2-(3-cyano-4-methyl-quinolin-2-yl)sulfanylphenyl]-4-methyl-benzamide

Systemtic Name: N-[2-(3-cyano-4-methyl-quinolin-2-yl)sulfanylphenyl]-4-methyl-benzamide Openeye Name: N-[2-[(3-cyano-4-methyl-2-quinolyl)sulfanyl]phenyl]-4-methyl-benzamide CAS Name: N-[2-[(3-cyano-4-methyl-2-quinolinyl)thio]phenyl]-4-methylbenzamide IUPAC Name: N-[2-(3-cyano-4-methylquinolin-2-yl)sulfanylphenyl]-4-methylbenzamide Traditional Name: N-[2-[(3-cyano-4-methyl-2-quinolyl)thio]phenyl]-4-methyl-benzamide Formula: C25H19N3OS MolecularWeight: 409.50286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SC3=NC4=CC=CC=C4C(=C3C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SC3=NC4=CC=CC=C4C(=C3C#N)C

InChI

InChI=1S/C25H19N3OS/c1-16-11-13-18(14-12-16)24(29)27-22-9-5-6-10-23(22)30-25-20(15-26)17(2)19-7-3-4-8-21(19)28-25/h3-14H,1-2H3,(H,27,29)