N-butyl-N-[(E)-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]butan-1-amine

Systemtic Name: N-butyl-N-[(E)-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]butan-1-amine Openeye Name: N-butyl-N-[(E)-3-(4-isopentylsulfanylphenyl)allyl]butan-1-amine CAS Name: N-butyl-N-[(E)-3-[4-(3-methylbutylthio)phenyl]prop-2-enyl]-1-butanamine IUPAC Name: N-butyl-N-[(E)-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]butan-1-amine Traditional Name: dibutyl-[(E)-3-[4-(isoamylthio)phenyl]allyl]amine Formula: C22H37NS MolecularWeight: 347.60088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC=CC1=CC=C(C=C1)SCCC(C)C

Isomeric SMILES

CCCCN(CCCC)C/C=C/C1=CC=C(C=C1)SCCC(C)C

InChI

InChI=1S/C22H37NS/c1-5-7-16-23(17-8-6-2)18-9-10-21-11-13-22(14-12-21)24-19-15-20(3)4/h9-14,20H,5-8,15-19H2,1-4H3/b10-9+