N,N-dimethyl-2-[4-[(Z)-1-(4-methylsulfanylphenyl)-2-phenyl-but-1-enyl]phenoxy]ethanamine

Systemtic Name: N,N-dimethyl-2-[4-[(Z)-1-(4-methylsulfanylphenyl)-2-phenyl-but-1-enyl]phenoxy]ethanamine Openeye Name: N,N-dimethyl-2-[4-[(Z)-1-(4-methylsulfanylphenyl)-2-phenyl-but-1-enyl]phenoxy]ethanamine CAS Name: N,N-dimethyl-2-[4-[(Z)-1-[4-(methylthio)phenyl]-2-phenylbut-1-enyl]phenoxy]ethanamine IUPAC Name: N,N-dimethyl-2-[4-[(Z)-1-(4-methylsulfanylphenyl)-2-phenylbut-1-enyl]phenoxy]ethanamine Traditional Name: dimethyl-[2-[4-[(Z)-1-[4-(methylthio)phenyl]-2-phenyl-but-1-enyl]phenoxy]ethyl]amine Formula: C27H31NOS MolecularWeight: 417.60614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)OCCN(C)C)C2=CC=C(C=C2)SC)C3=CC=CC=C3

Isomeric SMILES

CC/C(=C(\C1=CC=C(C=C1)OCCN(C)C)/C2=CC=C(C=C2)SC)/C3=CC=CC=C3

InChI

InChI=1S/C27H31NOS/c1-5-26(21-9-7-6-8-10-21)27(23-13-17-25(30-4)18-14-23)22-11-15-24(16-12-22)29-20-19-28(2)3/h6-18H,5,19-20H2,1-4H3/b27-26-