2-[[4-(furan-2-ylmethyl)-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-propan-1-one

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-propan-1-one Openeye Name: 2-[[4-(2-furylmethyl)-5-(4-methyl-1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-propan-1-one CAS Name: 2-[[4-(2-furanylmethyl)-5-(4-methyl-1-piperidinyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-1-propanone IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylpropan-1-one Traditional Name: 2-[[4-(2-furfuryl)-5-(4-methylpiperidino)-1,2,4-triazol-3-yl]thio]-1-phenyl-propan-1-one Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SC(C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SC(C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2S/c1-16-10-12-25(13-11-16)21-23-24-22(26(21)15-19-9-6-14-28-19)29-17(2)20(27)18-7-4-3-5-8-18/h3-9,14,16-17H,10-13,15H2,1-2H3