2-[(3-butylsulfanylphenyl)-phenyl-methoxy]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[(3-butylsulfanylphenyl)-phenyl-methoxy]-N,N-dimethyl-ethanamine Openeye Name: 2-[(3-butylsulfanylphenyl)-phenyl-methoxy]-N,N-dimethyl-ethanamine CAS Name: 2-[[3-(butylthio)phenyl]-phenylmethoxy]-N,N-dimethylethanamine IUPAC Name: 2-[(3-butylsulfanylphenyl)-phenylmethoxy]-N,N-dimethylethanamine Traditional Name: 2-[[3-(butylthio)phenyl]-phenyl-methoxy]ethyl-dimethyl-amine Formula: C21H29NOS MolecularWeight: 343.52606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=CC(=C1)C(C2=CC=CC=C2)OCCN(C)C

Isomeric SMILES

CCCCSC1=CC=CC(=C1)C(C2=CC=CC=C2)OCCN(C)C

InChI

InChI=1S/C21H29NOS/c1-4-5-16-24-20-13-9-12-19(17-20)21(23-15-14-22(2)3)18-10-7-6-8-11-18/h6-13,17,21H,4-5,14-16H2,1-3H3