N-(1-naphthalen-1-ylethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1-naphthalen-1-ylethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[1-(1-naphthyl)ethyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[1-(1-naphthalenyl)ethyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1-naphthalen-1-ylethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[1-(1-naphthyl)ethyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CSC3=NNC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CSC3=NNC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4OS/c1-15(18-13-7-11-16-8-5-6-12-19(16)18)23-20(27)14-28-22-24-21(25-26-22)17-9-3-2-4-10-17/h2-13,15H,14H2,1H3,(H,23,27)(H,24,25,26)