N-(4-acetamido-3-chloranyl-phenyl)-2-(oxolan-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-(oxolan-2-ylmethylsulfanyl)benzamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-2-(tetrahydrofuran-2-ylmethylsulfanyl)benzamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-(2-oxolanylmethylthio)benzamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-(oxolan-2-ylmethylsulfanyl)benzamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-2-(tetrahydrofurfurylthio)benzamide Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3CCCO3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3CCCO3)Cl

InChI

InChI=1S/C20H21ClN2O3S/c1-13(24)22-18-9-8-14(11-17(18)21)23-20(25)16-6-2-3-7-19(16)27-12-15-5-4-10-26-15/h2-3,6-9,11,15H,4-5,10,12H2,1H3,(H,22,24)(H,23,25)