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

Systemtic Name: N-(phenylmethyl)-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride Openeye Name: N-benzyl-N-[3-(4-pyridylsulfanyl)propyl]benzamide hydrochloride CAS Name: N-(phenylmethyl)-N-[3-(pyridin-4-ylthio)propyl]benzamide hydrochloride IUPAC Name: N-benzyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride Traditional Name: N-benzyl-N-[3-(4-pyridylthio)propyl]benzamide hydrochloride Formula: C22H23ClN2OS MolecularWeight: 398.94882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCSC2=CC=NC=C2)C(=O)C3=CC=CC=C3.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCSC2=CC=NC=C2)C(=O)C3=CC=CC=C3.Cl

InChI

InChI=1S/C22H22N2OS.ClH/c25-22(20-10-5-2-6-11-20)24(18-19-8-3-1-4-9-19)16-7-17-26-21-12-14-23-15-13-21;/h1-6,8-15H,7,16-18H2;1H