N-[3-(4-chloranyl-2-phenyl-phenyl)sulfanylpropyl]cyclohexanamine hydrochloride

Systemtic Name: N-[3-(4-chloranyl-2-phenyl-phenyl)sulfanylpropyl]cyclohexanamine hydrochloride Openeye Name: N-[3-(4-chloro-2-phenyl-phenyl)sulfanylpropyl]cyclohexanamine hydrochloride CAS Name: N-[3-[(4-chloro-2-phenylphenyl)thio]propyl]cyclohexanamine hydrochloride IUPAC Name: N-[3-(4-chloro-2-phenylphenyl)sulfanylpropyl]cyclohexanamine hydrochloride Traditional Name: 3-[(4-chloro-2-phenyl-phenyl)thio]propyl-cyclohexyl-amine hydrochloride Formula: C21H27Cl2NS MolecularWeight: 396.41678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCCCSC2=C(C=C(C=C2)Cl)C3=CC=CC=C3.Cl

Isomeric SMILES

C1CCC(CC1)NCCCSC2=C(C=C(C=C2)Cl)C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H26ClNS.ClH/c22-18-12-13-21(20(16-18)17-8-3-1-4-9-17)24-15-7-14-23-19-10-5-2-6-11-19;/h1,3-4,8-9,12-13,16,19,23H,2,5-7,10-11,14-15H2;1H