3-methyl-N-phenethyl-2-(phenylmethylsulfanyl)butan-1-amine

Systemtic Name: 3-methyl-N-phenethyl-2-(phenylmethylsulfanyl)butan-1-amine Openeye Name: 2-benzylsulfanyl-3-methyl-N-phenethyl-butan-1-amine CAS Name: 3-methyl-N-phenethyl-2-(phenylmethylthio)-1-butanamine IUPAC Name: 2-benzylsulfanyl-3-methyl-N-phenethylbutan-1-amine Traditional Name: [2-(benzylthio)-3-methyl-butyl]-phenethyl-amine Formula: C20H27NS MolecularWeight: 313.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNCCC1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(CNCCC1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C20H27NS/c1-17(2)20(22-16-19-11-7-4-8-12-19)15-21-14-13-18-9-5-3-6-10-18/h3-12,17,20-21H,13-16H2,1-2H3