2-(3-chloranylpyridin-2-yl)sulfanyl-N-(1-phenylbutyl)propanamide

Systemtic Name: 2-(3-chloranylpyridin-2-yl)sulfanyl-N-(1-phenylbutyl)propanamide Openeye Name: 2-[(3-chloro-2-pyridyl)sulfanyl]-N-(1-phenylbutyl)propanamide CAS Name: 2-[(3-chloro-2-pyridinyl)thio]-N-(1-phenylbutyl)propanamide IUPAC Name: 2-(3-chloropyridin-2-yl)sulfanyl-N-(1-phenylbutyl)propanamide Traditional Name: 2-[(3-chloro-2-pyridyl)thio]-N-(1-phenylbutyl)propionamide Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)SC2=C(C=CC=N2)Cl

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)SC2=C(C=CC=N2)Cl

InChI

InChI=1S/C18H21ClN2OS/c1-3-8-16(14-9-5-4-6-10-14)21-17(22)13(2)23-18-15(19)11-7-12-20-18/h4-7,9-13,16H,3,8H2,1-2H3,(H,21,22)