2-[[5-(4-aminophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)ethanamide

Systemtic Name: 2-[[5-(4-aminophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)ethanamide Openeye Name: 2-[[5-(4-aminophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-benzhydryl-acetamide CAS Name: 2-[[5-(4-aminophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(diphenylmethyl)acetamide IUPAC Name: 2-[[5-(4-aminophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-benzhydrylacetamide Traditional Name: 2-[[5-(4-aminophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-benzhydryl-acetamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)N

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)N

InChI

InChI=1S/C25H25N5OS/c1-2-30-24(20-13-15-21(26)16-14-20)28-29-25(30)32-17-22(31)27-23(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-16,23H,2,17,26H2,1H3,(H,27,31)