3-[(4-butoxy-3-chloranyl-phenyl)methylsulfanyl]propan-1-amine

Systemtic Name: 3-[(4-butoxy-3-chloranyl-phenyl)methylsulfanyl]propan-1-amine Openeye Name: 3-[(4-butoxy-3-chloro-phenyl)methylsulfanyl]propan-1-amine CAS Name: 3-[(4-butoxy-3-chlorophenyl)methylthio]-1-propanamine IUPAC Name: 3-[(4-butoxy-3-chlorophenyl)methylsulfanyl]propan-1-amine Traditional Name: 3-[(4-butoxy-3-chloro-benzyl)thio]propylamine Formula: C14H22ClNOS MolecularWeight: 287.84858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CSCCCN)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CSCCCN)Cl

InChI

InChI=1S/C14H22ClNOS/c1-2-3-8-17-14-6-5-12(10-13(14)15)11-18-9-4-7-16/h5-6,10H,2-4,7-9,11,16H2,1H3