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

Systemtic Name: 3-[(3-chloranyl-4-propoxy-phenyl)methylsulfanyl]propan-1-amine Openeye Name: 3-[(3-chloro-4-propoxy-phenyl)methylsulfanyl]propan-1-amine CAS Name: 3-[(3-chloro-4-propoxyphenyl)methylthio]-1-propanamine IUPAC Name: 3-[(3-chloro-4-propoxyphenyl)methylsulfanyl]propan-1-amine Traditional Name: 3-[(3-chloro-4-propoxy-benzyl)thio]propylamine Formula: C13H20ClNOS MolecularWeight: 273.822

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CSCCCN)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CSCCCN)Cl

InChI

InChI=1S/C13H20ClNOS/c1-2-7-16-13-5-4-11(9-12(13)14)10-17-8-3-6-15/h4-5,9H,2-3,6-8,10,15H2,1H3