N'-[4-(4-chlorophenyl)sulfanylbutyl]ethane-1,2-diamine

Systemtic Name: N'-[4-(4-chlorophenyl)sulfanylbutyl]ethane-1,2-diamine Openeye Name: N'-[4-(4-chlorophenyl)sulfanylbutyl]ethane-1,2-diamine CAS Name: N'-[4-[(4-chlorophenyl)thio]butyl]ethane-1,2-diamine IUPAC Name: N'-[4-(4-chlorophenyl)sulfanylbutyl]ethane-1,2-diamine Traditional Name: 2-aminoethyl-[4-[(4-chlorophenyl)thio]butyl]amine Formula: C12H19ClN2S MolecularWeight: 258.81066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCCCNCCN)Cl

Isomeric SMILES

C1=CC(=CC=C1SCCCCNCCN)Cl

InChI

InChI=1S/C12H19ClN2S/c13-11-3-5-12(6-4-11)16-10-2-1-8-15-9-7-14/h3-6,15H,1-2,7-10,14H2