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

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-2-phenyl-acetamide CAS Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]thio]-2-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-N-propan-2-ylacetamide Traditional Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]thio]-N-isopropyl-2-phenyl-acetamide Formula: C22H25ClN4OS MolecularWeight: 428.9781

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC(C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC(C)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN4OS/c1-4-14-27-20(17-10-12-18(23)13-11-17)25-26-22(27)29-19(21(28)24-15(2)3)16-8-6-5-7-9-16/h5-13,15,19H,4,14H2,1-3H3,(H,24,28)