2-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[[4-(2-furylmethyl)-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[4-(2-furanylmethyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[[4-(2-furfuryl)-5-piperidino-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SCC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SCC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C20H21N5O2S/c1-4-10-24(11-5-1)19-22-23-20(25(19)13-15-7-6-12-26-15)28-14-18-21-16-8-2-3-9-17(16)27-18/h2-3,6-9,12H,1,4-5,10-11,13-14H2