N-[(3-methylsulfanylphenyl)methyl]-1-(3-phenylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(3-methylsulfanylphenyl)methyl]-1-(3-phenylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-[(3-methylsulfanylphenyl)methyl]-1-(3-phenylpropyl)triazole-4-carboxamide CAS Name: N-[[3-(methylthio)phenyl]methyl]-1-(3-phenylpropyl)-4-triazolecarboxamide IUPAC Name: N-[(3-methylsulfanylphenyl)methyl]-1-(3-phenylpropyl)triazole-4-carboxamide Traditional Name: N-[3-(methylthio)benzyl]-1-(3-phenylpropyl)triazole-4-carboxamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)CNC(=O)C2=CN(N=N2)CCCC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)CNC(=O)C2=CN(N=N2)CCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-26-18-11-5-9-17(13-18)14-21-20(25)19-15-24(23-22-19)12-6-10-16-7-3-2-4-8-16/h2-5,7-9,11,13,15H,6,10,12,14H2,1H3,(H,21,25)