2-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-acetamide CAS Name: 2-[[4-(3-chlorophenyl)-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-ylacetamide Traditional Name: 2-[[4-(3-chlorophenyl)-5-pyrrolidino-1,2,4-triazol-3-yl]thio]-N-isopropyl-acetamide Formula: C17H22ClN5OS MolecularWeight: 379.90748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=NN=C(N1C2=CC(=CC=C2)Cl)N3CCCC3

Isomeric SMILES

CC(C)NC(=O)CSC1=NN=C(N1C2=CC(=CC=C2)Cl)N3CCCC3

InChI

InChI=1S/C17H22ClN5OS/c1-12(2)19-15(24)11-25-17-21-20-16(22-8-3-4-9-22)23(17)14-7-5-6-13(18)10-14/h5-7,10,12H,3-4,8-9,11H2,1-2H3,(H,19,24)