2-[[4-azanyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-(1-naphthyl)acetamide CAS Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-naphthalen-1-ylacetamide Traditional Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-N-(1-naphthyl)acetamide Formula: C22H20ClN5OS MolecularWeight: 437.9451

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)CSC3=NN=C(N3N)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)CSC3=NN=C(N3N)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H20ClN5OS/c1-2-27(19-12-6-8-15-7-3-4-11-18(15)19)20(29)14-30-22-26-25-21(28(22)24)16-9-5-10-17(23)13-16/h3-13H,2,14,24H2,1H3