N-[3-(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)propyl]ethanamide

Systemtic Name: N-[3-(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)propyl]ethanamide Openeye Name: N-[3-(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)propyl]acetamide CAS Name: N-[3-[5-(phenacylthio)-4-phenyl-1,2,4-triazol-3-yl]propyl]acetamide IUPAC Name: N-[3-(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)propyl]acetamide Traditional Name: N-[3-[5-(phenacylthio)-4-phenyl-1,2,4-triazol-3-yl]propyl]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-16(26)22-14-8-13-20-23-24-21(25(20)18-11-6-3-7-12-18)28-15-19(27)17-9-4-2-5-10-17/h2-7,9-12H,8,13-15H2,1H3,(H,22,26)