N'-[2-(4-chlorophenyl)sulfanylethyl]butane-1,4-diamine

Systemtic Name: N'-[2-(4-chlorophenyl)sulfanylethyl]butane-1,4-diamine Openeye Name: N'-[2-(4-chlorophenyl)sulfanylethyl]butane-1,4-diamine CAS Name: N'-[2-[(4-chlorophenyl)thio]ethyl]butane-1,4-diamine IUPAC Name: N'-[2-(4-chlorophenyl)sulfanylethyl]butane-1,4-diamine Traditional Name: 4-aminobutyl-[2-[(4-chlorophenyl)thio]ethyl]amine Formula: C12H19ClN2S MolecularWeight: 258.81066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCNCCCCN)Cl

Isomeric SMILES

C1=CC(=CC=C1SCCNCCCCN)Cl

InChI

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