4-[(4,7,8-trimethylquinolin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: 4-[(4,7,8-trimethylquinolin-2-yl)sulfanylmethyl]benzamide Openeye Name: 4-[(4,7,8-trimethyl-2-quinolyl)sulfanylmethyl]benzamide CAS Name: 4-[[(4,7,8-trimethyl-2-quinolinyl)thio]methyl]benzamide IUPAC Name: 4-[(4,7,8-trimethylquinolin-2-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[(4,7,8-trimethyl-2-quinolyl)thio]methyl]benzamide Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)SCC3=CC=C(C=C3)C(=O)N)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)SCC3=CC=C(C=C3)C(=O)N)C)C

InChI

InChI=1S/C20H20N2OS/c1-12-4-9-17-13(2)10-18(22-19(17)14(12)3)24-11-15-5-7-16(8-6-15)20(21)23/h4-10H,11H2,1-3H3,(H2,21,23)