4-[4-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidine

Systemtic Name: 4-[4-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidine Openeye Name: 1-[(E)-2-methyl-3-phenyl-allyl]-4-[4-methyl-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine CAS Name: 4-[4-methyl-5-(2-oxolanylmethylthio)-1,2,4-triazol-3-yl]-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidine IUPAC Name: 4-[4-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidine Traditional Name: 1-[(E)-2-methyl-3-phenyl-allyl]-4-[4-methyl-5-(tetrahydrofurfurylthio)-1,2,4-triazol-3-yl]piperidine Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN2CCC(CC2)C3=NN=C(N3C)SCC4CCCO4

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/CN2CCC(CC2)C3=NN=C(N3C)SCC4CCCO4

InChI

InChI=1S/C23H32N4OS/c1-18(15-19-7-4-3-5-8-19)16-27-12-10-20(11-13-27)22-24-25-23(26(22)2)29-17-21-9-6-14-28-21/h3-5,7-8,15,20-21H,6,9-14,16-17H2,1-2H3/b18-15+