(E)-N,N-diethyl-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-en-1-amine

Systemtic Name: (E)-N,N-diethyl-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-en-1-amine Openeye Name: (E)-N,N-diethyl-3-(4-isopentylsulfanylphenyl)prop-2-en-1-amine CAS Name: (E)-N,N-diethyl-3-[4-(3-methylbutylthio)phenyl]-2-propen-1-amine IUPAC Name: (E)-N,N-diethyl-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-en-1-amine Traditional Name: diethyl-[(E)-3-[4-(isoamylthio)phenyl]allyl]amine Formula: C18H29NS MolecularWeight: 291.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC=CC1=CC=C(C=C1)SCCC(C)C

Isomeric SMILES

CCN(CC)C/C=C/C1=CC=C(C=C1)SCCC(C)C

InChI

InChI=1S/C18H29NS/c1-5-19(6-2)14-7-8-17-9-11-18(12-10-17)20-15-13-16(3)4/h7-12,16H,5-6,13-15H2,1-4H3/b8-7+