4-tert-butyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride

Systemtic Name: 4-tert-butyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride Openeye Name: 4-tert-butyl-N-[3-(4-pyridylsulfanyl)propyl]benzamide hydrochloride CAS Name: 4-tert-butyl-N-[3-(pyridin-4-ylthio)propyl]benzamide hydrochloride IUPAC Name: 4-tert-butyl-N-(3-pyridin-4-ylsulfanylpropyl)benzamide hydrochloride Traditional Name: 4-tert-butyl-N-[3-(4-pyridylthio)propyl]benzamide hydrochloride Formula: C19H25ClN2OS MolecularWeight: 364.9326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCCSC2=CC=NC=C2.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCCSC2=CC=NC=C2.Cl

InChI

InChI=1S/C19H24N2OS.ClH/c1-19(2,3)16-7-5-15(6-8-16)18(22)21-11-4-14-23-17-9-12-20-13-10-17;/h5-10,12-13H,4,11,14H2,1-3H3,(H,21,22);1H