5-[[4-(3,4-dichlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-yl-pentan-1-one

Systemtic Name: 5-[[4-(3,4-dichlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-yl-pentan-1-one Openeye Name: 5-[[4-(3,4-dichlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1-piperidyl)pentan-1-one CAS Name: 5-[[4-(3,4-dichlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-(1-piperidinyl)-1-pentanone IUPAC Name: 5-[[4-(3,4-dichlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-ylpentan-1-one Traditional Name: 5-[[4-(3,4-dichlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-piperidino-pentan-1-one Formula: C24H26Cl2N4OS MolecularWeight: 489.46044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCCCSC2=NN=C(N2C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CCCCSC2=NN=C(N2C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H26Cl2N4OS/c25-20-13-12-19(17-21(20)26)30-23(18-9-3-1-4-10-18)27-28-24(30)32-16-8-5-11-22(31)29-14-6-2-7-15-29/h1,3-4,9-10,12-13,17H,2,5-8,11,14-16H2