4-methyl-1-[(E)-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]piperidine

Systemtic Name: 4-methyl-1-[(E)-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]piperidine Openeye Name: 1-[(E)-3-(4-isopentylsulfanylphenyl)allyl]-4-methyl-piperidine CAS Name: 4-methyl-1-[(E)-3-[4-(3-methylbutylthio)phenyl]prop-2-enyl]piperidine IUPAC Name: 4-methyl-1-[(E)-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]piperidine Traditional Name: 1-[(E)-3-[4-(isoamylthio)phenyl]allyl]-4-methyl-piperidine Formula: C20H31NS MolecularWeight: 317.53184

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC=CC2=CC=C(C=C2)SCCC(C)C

Isomeric SMILES

CC1CCN(CC1)C/C=C/C2=CC=C(C=C2)SCCC(C)C

InChI

InChI=1S/C20H31NS/c1-17(2)12-16-22-20-8-6-19(7-9-20)5-4-13-21-14-10-18(3)11-15-21/h4-9,17-18H,10-16H2,1-3H3/b5-4+