2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorophenyl)butanamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorophenyl)butyramide Formula: C18H24FN5OS MolecularWeight: 377.479463

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NN=C(N2N)C3CCCCC3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NN=C(N2N)C3CCCCC3

InChI

InChI=1S/C18H24FN5OS/c1-2-15(17(25)21-14-10-8-13(19)9-11-14)26-18-23-22-16(24(18)20)12-6-4-3-5-7-12/h8-12,15H,2-7,20H2,1H3,(H,21,25)