4-chloranyl-2-[2-(methylamino)-1-phenyl-ethyl]sulfanyl-benzenecarbonitrile hydrochloride

Systemtic Name: 4-chloranyl-2-[2-(methylamino)-1-phenyl-ethyl]sulfanyl-benzenecarbonitrile hydrochloride Openeye Name: 4-chloro-2-[2-(methylamino)-1-phenyl-ethyl]sulfanyl-benzonitrile hydrochloride CAS Name: 4-chloro-2-[[2-(methylamino)-1-phenylethyl]thio]benzonitrile hydrochloride IUPAC Name: 4-chloro-2-[2-(methylamino)-1-phenylethyl]sulfanylbenzonitrile hydrochloride Traditional Name: 4-chloro-2-[[2-(methylamino)-1-phenyl-ethyl]thio]benzonitrile hydrochloride Formula: C16H16Cl2N2S MolecularWeight: 339.28264

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(C1=CC=CC=C1)SC2=C(C=CC(=C2)Cl)C#N.Cl

Isomeric SMILES

CNCC(C1=CC=CC=C1)SC2=C(C=CC(=C2)Cl)C#N.Cl

InChI

InChI=1S/C16H15ClN2S.ClH/c1-19-11-16(12-5-3-2-4-6-12)20-15-9-14(17)8-7-13(15)10-18;/h2-9,16,19H,11H2,1H3;1H