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

Systemtic Name: 2-[[5-phenethyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-benzyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[[5-phenethyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-benzyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-benzyl-2-[(4-benzyl-5-phenethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H26N4OS/c31-25(27-18-22-12-6-2-7-13-22)20-32-26-29-28-24(17-16-21-10-4-1-5-11-21)30(26)19-23-14-8-3-9-15-23/h1-15H,16-20H2,(H,27,31)