2-(2-butyl-3-naphthalen-1-ylsulfanyl-phenyl)ethanamine

Systemtic Name: 2-(2-butyl-3-naphthalen-1-ylsulfanyl-phenyl)ethanamine Openeye Name: 2-[2-butyl-3-(1-naphthylsulfanyl)phenyl]ethanamine CAS Name: 2-[2-butyl-3-(1-naphthalenylthio)phenyl]ethanamine IUPAC Name: 2-(2-butyl-3-naphthalen-1-ylsulfanylphenyl)ethanamine Traditional Name: 2-[2-butyl-3-(1-naphthylthio)phenyl]ethylamine Formula: C22H25NS MolecularWeight: 335.5056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1SC2=CC=CC3=CC=CC=C32)CCN

Isomeric SMILES

CCCCC1=C(C=CC=C1SC2=CC=CC3=CC=CC=C32)CCN

InChI

InChI=1S/C22H25NS/c1-2-3-11-19-18(15-16-23)10-7-14-21(19)24-22-13-6-9-17-8-4-5-12-20(17)22/h4-10,12-14H,2-3,11,15-16,23H2,1H3