2-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[[4-(2-furylmethyl)-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: 2-[[4-(2-furanylmethyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: 2-[[4-(2-furfuryl)-5-piperidino-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SC(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SC(C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C20H23N5O2S/c21-18(26)17(15-8-3-1-4-9-15)28-20-23-22-19(24-11-5-2-6-12-24)25(20)14-16-10-7-13-27-16/h1,3-4,7-10,13,17H,2,5-6,11-12,14H2,(H2,21,26)