1-[[4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]methyl]piperidine

Systemtic Name: 1-[[4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]methyl]piperidine Openeye Name: 1-[[5-[(E)-cinnamyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine CAS Name: 1-[[4-phenyl-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-3-yl]methyl]piperidine IUPAC Name: 1-[[4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]methyl]piperidine Traditional Name: 1-[[5-[[(E)-cinnamyl]thio]-4-phenyl-1,2,4-triazol-3-yl]methyl]piperidine Formula: C23H26N4S MolecularWeight: 390.54434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NN=C(N2C3=CC=CC=C3)SCC=CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=NN=C(N2C3=CC=CC=C3)SC/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H26N4S/c1-4-11-20(12-5-1)13-10-18-28-23-25-24-22(19-26-16-8-3-9-17-26)27(23)21-14-6-2-7-15-21/h1-2,4-7,10-15H,3,8-9,16-19H2/b13-10+