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

Systemtic Name: 2-[(5-phenethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1H-1,2,4-triazol-5-yl)ethanamide Openeye Name: 2-[(5-phenethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1H-1,2,4-triazol-5-yl)acetamide CAS Name: 2-[(5-phenethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(1H-1,2,4-triazol-5-yl)acetamide IUPAC Name: 2-[(5-phenethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1H-1,2,4-triazol-5-yl)acetamide Traditional Name: 2-[(5-phenethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(1H-1,2,4-triazol-5-yl)acetamide Formula: C20H19N7OS MolecularWeight: 405.47616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=NC=NN4

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=NC=NN4

InChI

InChI=1S/C20H19N7OS/c28-18(23-19-21-14-22-25-19)13-29-20-26-24-17(12-11-15-7-3-1-4-8-15)27(20)16-9-5-2-6-10-16/h1-10,14H,11-13H2,(H2,21,22,23,25,28)