N-(2-methylquinolin-6-yl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(2-methylquinolin-6-yl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(2-methyl-6-quinolyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(2-methyl-6-quinolinyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(2-methylquinolin-6-yl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(2-methyl-6-quinolyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)CSC4=NC=NN4

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)CSC4=NC=NN4

InChI

InChI=1S/C20H17N5OS/c1-13-5-6-15-10-17(7-8-18(15)23-13)24-19(26)16-4-2-3-14(9-16)11-27-20-21-12-22-25-20/h2-10,12H,11H2,1H3,(H,24,26)(H,21,22,25)