N-(4-cyanophenyl)-3-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-cyanophenyl)-3-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-cyanophenyl)-3-[[4-(2-furylmethyl)-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-cyanophenyl)-3-[[4-(2-furanylmethyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-cyanophenyl)-3-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-cyanophenyl)-3-[[4-(2-furfuryl)-5-piperidino-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H24N6O2S MolecularWeight: 436.52996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SCCC(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SCCC(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H24N6O2S/c23-15-17-6-8-18(9-7-17)24-20(29)10-14-31-22-26-25-21(27-11-2-1-3-12-27)28(22)16-19-5-4-13-30-19/h4-9,13H,1-3,10-12,14,16H2,(H,24,29)