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

Systemtic Name: N-quinolin-3-yl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(3-quinolyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(3-quinolinyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-quinolin-3-yl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(3-quinolyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C19H15N5OS MolecularWeight: 361.4203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)C3=CC(=CC=C3)CSC4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)C3=CC(=CC=C3)CSC4=NC=NN4

InChI

InChI=1S/C19H15N5OS/c25-18(23-16-9-14-5-1-2-7-17(14)20-10-16)15-6-3-4-13(8-15)11-26-19-21-12-22-24-19/h1-10,12H,11H2,(H,23,25)(H,21,22,24)