2-[2-(4-chlorophenyl)sulfanylphenyl]-5-(dimethylamino)pentanenitrile hydrochloride

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylphenyl]-5-(dimethylamino)pentanenitrile hydrochloride Openeye Name: 2-[2-(4-chlorophenyl)sulfanylphenyl]-5-(dimethylamino)pentanenitrile hydrochloride CAS Name: 2-[2-[(4-chlorophenyl)thio]phenyl]-5-(dimethylamino)pentanenitrile hydrochloride IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylphenyl]-5-(dimethylamino)pentanenitrile hydrochloride Traditional Name: 2-[2-[(4-chlorophenyl)thio]phenyl]-5-(dimethylamino)valeronitrile hydrochloride Formula: C19H22Cl2N2S MolecularWeight: 381.36238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC(C#N)C1=CC=CC=C1SC2=CC=C(C=C2)Cl.Cl

Isomeric SMILES

CN(C)CCCC(C#N)C1=CC=CC=C1SC2=CC=C(C=C2)Cl.Cl

InChI

InChI=1S/C19H21ClN2S.ClH/c1-22(2)13-5-6-15(14-21)18-7-3-4-8-19(18)23-17-11-9-16(20)10-12-17;/h3-4,7-12,15H,5-6,13H2,1-2H3;1H