1,3-benzodioxol-5-yl-[4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-1-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]-1-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]piperidino]methanone Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H24N4O3S/c1-26-21(24-25-23(26)31-14-16-5-3-2-4-6-16)17-9-11-27(12-10-17)22(28)18-7-8-19-20(13-18)30-15-29-19/h2-8,13,17H,9-12,14-15H2,1H3