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

Systemtic Name: 2-[[4-(4-chlorophenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(diethylamino)phenyl]ethanamide Openeye Name: 2-[[4-(4-chlorophenyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(diethylamino)phenyl]acetamide CAS Name: 2-[[4-(4-chlorophenyl)-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[4-(diethylamino)phenyl]acetamide IUPAC Name: 2-[[4-(4-chlorophenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(diethylamino)phenyl]acetamide Traditional Name: 2-[[4-(4-chlorophenyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[4-(diethylamino)phenyl]acetamide Formula: C25H25ClN6OS MolecularWeight: 493.0236

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C25H25ClN6OS/c1-3-31(4-2)20-14-10-19(11-15-20)28-23(33)17-34-25-30-29-24(22-7-5-6-16-27-22)32(25)21-12-8-18(26)9-13-21/h5-16H,3-4,17H2,1-2H3,(H,28,33)