3-(4-chloranyl-2-methylsulfanyl-phenyl)butan-1-amine

Systemtic Name: 3-(4-chloranyl-2-methylsulfanyl-phenyl)butan-1-amine Openeye Name: 3-(4-chloro-2-methylsulfanyl-phenyl)butan-1-amine CAS Name: 3-[4-chloro-2-(methylthio)phenyl]-1-butanamine IUPAC Name: 3-(4-chloro-2-methylsulfanylphenyl)butan-1-amine Traditional Name: 3-[4-chloro-2-(methylthio)phenyl]butylamine Formula: C11H16ClNS MolecularWeight: 229.76944

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN)C1=C(C=C(C=C1)Cl)SC

Isomeric SMILES

CC(CCN)C1=C(C=C(C=C1)Cl)SC

InChI

InChI=1S/C11H16ClNS/c1-8(5-6-13)10-4-3-9(12)7-11(10)14-2/h3-4,7-8H,5-6,13H2,1-2H3