2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-fluorophenyl)-(2-thienyl)methyl]acetamide CAS Name: 2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)-(2-thienyl)methyl]acetamide Formula: C23H26FN5OS2 MolecularWeight: 471.613843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC(=O)NC(C4=CC=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC(=O)NC(C4=CC=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C23H26FN5OS2/c24-17-8-6-16(7-9-17)21(19-5-4-14-31-19)25-20(30)15-32-23-27-26-22(29(23)18-10-11-18)28-12-2-1-3-13-28/h4-9,14,18,21H,1-3,10-13,15H2,(H,25,30)