2-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-piperidin-1-ylphenyl)propanamide

Systemtic Name: 2-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-piperidin-1-ylphenyl)propanamide Openeye Name: N-[4-(1-piperidyl)phenyl]-2-[[4-(tetrahydrofuran-2-ylmethyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-[4-(1-piperidinyl)phenyl]propanamide IUPAC Name: 2-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-piperidin-1-ylphenyl)propanamide Traditional Name: N-(4-piperidinophenyl)-2-[[4-(tetrahydrofurfuryl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C25H31N5O2S2 MolecularWeight: 497.67594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)SC3=NN=C(N3CC4CCCO4)C5=CC=CS5

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)SC3=NN=C(N3CC4CCCO4)C5=CC=CS5

InChI

InChI=1S/C25H31N5O2S2/c1-18(24(31)26-19-9-11-20(12-10-19)29-13-3-2-4-14-29)34-25-28-27-23(22-8-6-16-33-22)30(25)17-21-7-5-15-32-21/h6,8-12,16,18,21H,2-5,7,13-15,17H2,1H3,(H,26,31)