4-phenyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride

Systemtic Name: 4-phenyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride Openeye Name: 4-phenyl-N-[3-(4-pyridylsulfanyl)propyl]benzamide hydrochloride CAS Name: 4-phenyl-N-[3-(pyridin-4-ylthio)propyl]benzamide hydrochloride IUPAC Name: 4-phenyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride Traditional Name: 4-phenyl-N-[3-(4-pyridylthio)propyl]benzamide hydrochloride Formula: C21H21ClN2OS MolecularWeight: 384.92224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCCCSC3=CC=NC=C3.Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCCCSC3=CC=NC=C3.Cl

InChI

InChI=1S/C21H20N2OS.ClH/c24-21(23-13-4-16-25-20-11-14-22-15-12-20)19-9-7-18(8-10-19)17-5-2-1-3-6-17;/h1-3,5-12,14-15H,4,13,16H2,(H,23,24);1H