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

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-4-yl-ethanamide Openeye Name: 2-[[5-(4-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-pyridyl)acetamide CAS Name: 2-[[5-(4-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-pyridin-4-ylacetamide IUPAC Name: 2-[[5-(4-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-4-ylacetamide Traditional Name: 2-[[5-(4-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-(4-pyridyl)acetamide Formula: C21H22ClN5OS MolecularWeight: 427.95028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN5OS/c22-16-8-6-15(7-9-16)20-25-26-21(27(20)18-4-2-1-3-5-18)29-14-19(28)24-17-10-12-23-13-11-17/h6-13,18H,1-5,14H2,(H,23,24,28)