4-[4-(3-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-[(E)-2-methylbut-2-enyl]piperidine

Systemtic Name: 4-[4-(3-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-[(E)-2-methylbut-2-enyl]piperidine Openeye Name: 4-[4-(3-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-[(E)-2-methylbut-2-enyl]piperidine CAS Name: 4-[4-(3-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-1-[(E)-2-methylbut-2-enyl]piperidine IUPAC Name: 4-[4-(3-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-[(E)-2-methylbut-2-enyl]piperidine Traditional Name: 4-[4-(3-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-1-[(E)-2-methylbut-2-enyl]piperidine Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CN1CCC(CC1)C2=NN=C(N2C3=CC(=CC=C3)OC)SC

Isomeric SMILES

C/C=C(\C)/CN1CCC(CC1)C2=NN=C(N2C3=CC(=CC=C3)OC)SC

InChI

InChI=1S/C20H28N4OS/c1-5-15(2)14-23-11-9-16(10-12-23)19-21-22-20(26-4)24(19)17-7-6-8-18(13-17)25-3/h5-8,13,16H,9-12,14H2,1-4H3/b15-5+