4-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]-sulfanyl-methyl]-1H-quinolin-2-one

Systemtic Name: 4-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]-sulfanyl-methyl]-1H-quinolin-2-one Openeye Name: 4-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]-sulfanyl-methyl]-1H-quinolin-2-one CAS Name: 4-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]-mercaptomethyl]-1H-quinolin-2-one IUPAC Name: 4-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]-sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]-mercapto-methyl]carbostyril Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1C(C2=CC(=O)NC3=CC=CC=C32)S)C4=CC(=CC=C4)C

Isomeric SMILES

CCN1C(=NN=C1C(C2=CC(=O)NC3=CC=CC=C32)S)C4=CC(=CC=C4)C

InChI

InChI=1S/C21H20N4OS/c1-3-25-20(14-8-6-7-13(2)11-14)23-24-21(25)19(27)16-12-18(26)22-17-10-5-4-9-15(16)17/h4-12,19,27H,3H2,1-2H3,(H,22,26)