3-methyl-N-(2-phenylsulfanylethyl)butan-1-amine

Systemtic Name: 3-methyl-N-(2-phenylsulfanylethyl)butan-1-amine Openeye Name: 3-methyl-N-(2-phenylsulfanylethyl)butan-1-amine CAS Name: 3-methyl-N-[2-(phenylthio)ethyl]-1-butanamine IUPAC Name: 3-methyl-N-(2-phenylsulfanylethyl)butan-1-amine Traditional Name: isoamyl-[2-(phenylthio)ethyl]amine Formula: C13H21NS MolecularWeight: 223.37754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCCSC1=CC=CC=C1

Isomeric SMILES

CC(C)CCNCCSC1=CC=CC=C1

InChI

InChI=1S/C13H21NS/c1-12(2)8-9-14-10-11-15-13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3