2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]ethanamide

Systemtic Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]ethanamide Openeye Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]acetamide CAS Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]acetamide Traditional Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]acetamide Formula: C27H33N5O2S MolecularWeight: 491.64822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)N5CCCCC5

InChI

InChI=1S/C27H33N5O2S/c1-34-23-14-12-20(13-15-23)24(31-16-6-3-7-17-31)18-28-25(33)19-35-27-30-29-26(21-10-11-21)32(27)22-8-4-2-5-9-22/h2,4-5,8-9,12-15,21,24H,3,6-7,10-11,16-19H2,1H3,(H,28,33)