N-butyl-N-[2-(4-chlorophenyl)sulfanylethyl]butan-1-amine

Systemtic Name: N-butyl-N-[2-(4-chlorophenyl)sulfanylethyl]butan-1-amine Openeye Name: N-butyl-N-[2-(4-chlorophenyl)sulfanylethyl]butan-1-amine CAS Name: N-butyl-N-[2-[(4-chlorophenyl)thio]ethyl]-1-butanamine IUPAC Name: N-butyl-N-[2-(4-chlorophenyl)sulfanylethyl]butan-1-amine Traditional Name: dibutyl-[2-[(4-chlorophenyl)thio]ethyl]amine Formula: C16H26ClNS MolecularWeight: 299.90234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCN(CCCC)CCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H26ClNS/c1-3-5-11-18(12-6-4-2)13-14-19-16-9-7-15(17)8-10-16/h7-10H,3-6,11-14H2,1-2H3