N-heptan-4-yl-3-methylsulfanyl-aniline

Systemtic Name: N-heptan-4-yl-3-methylsulfanyl-aniline Openeye Name: 3-methylsulfanyl-N-(1-propylbutyl)aniline CAS Name: N-heptan-4-yl-3-(methylthio)aniline IUPAC Name: N-heptan-4-yl-3-methylsulfanylaniline Traditional Name: [3-(methylthio)phenyl]-(1-propylbutyl)amine Formula: C14H23NS MolecularWeight: 237.40412

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC(=CC=C1)SC

Isomeric SMILES

CCCC(CCC)NC1=CC(=CC=C1)SC

InChI

InChI=1S/C14H23NS/c1-4-7-12(8-5-2)15-13-9-6-10-14(11-13)16-3/h6,9-12,15H,4-5,7-8H2,1-3H3