N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-[5-(p-tolyl)-1,2,4-thiadiazol-3-yl]acetamide CAS Name: N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-[5-(p-tolyl)-1,2,4-thiadiazol-3-yl]acetamide Formula: C21H18N4OS2 MolecularWeight: 406.52382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NS2)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NS2)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C

InChI

InChI=1S/C21H18N4OS2/c1-13-7-9-15(10-8-13)20-24-21(25-28-20)23-18(26)12-27-19-11-14(2)16-5-3-4-6-17(16)22-19/h3-11H,12H2,1-2H3,(H,23,25,26)