4-methyl-3-phenylsulfanyl-N-prop-2-enyl-heptan-3-amine

Systemtic Name: 4-methyl-3-phenylsulfanyl-N-prop-2-enyl-heptan-3-amine Openeye Name: N-allyl-4-methyl-3-phenylsulfanyl-heptan-3-amine CAS Name: 4-methyl-3-(phenylthio)-N-prop-2-enyl-3-heptanamine IUPAC Name: 4-methyl-3-phenylsulfanyl-N-prop-2-enylheptan-3-amine Traditional Name: allyl-[1-ethyl-2-methyl-1-(phenylthio)pentyl]amine Formula: C17H27NS MolecularWeight: 277.46798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(CC)(NCC=C)SC1=CC=CC=C1

Isomeric SMILES

CCCC(C)C(CC)(NCC=C)SC1=CC=CC=C1

InChI

InChI=1S/C17H27NS/c1-5-11-15(4)17(7-3,18-14-6-2)19-16-12-9-8-10-13-16/h6,8-10,12-13,15,18H,2,5,7,11,14H2,1,3-4H3