N-(3-chloranyl-4-pyridin-2-ylsulfanyl-phenyl)-2,3,4-trimethoxy-benzamide

Systemtic Name: N-(3-chloranyl-4-pyridin-2-ylsulfanyl-phenyl)-2,3,4-trimethoxy-benzamide Openeye Name: N-[3-chloro-4-(2-pyridylsulfanyl)phenyl]-2,3,4-trimethoxy-benzamide CAS Name: N-[3-chloro-4-(2-pyridinylthio)phenyl]-2,3,4-trimethoxybenzamide IUPAC Name: N-(3-chloro-4-pyridin-2-ylsulfanylphenyl)-2,3,4-trimethoxybenzamide Traditional Name: N-[3-chloro-4-(2-pyridylthio)phenyl]-2,3,4-trimethoxy-benzamide Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)NC2=CC(=C(C=C2)SC3=CC=CC=N3)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)NC2=CC(=C(C=C2)SC3=CC=CC=N3)Cl)OC)OC

InChI

InChI=1S/C21H19ClN2O4S/c1-26-16-9-8-14(19(27-2)20(16)28-3)21(25)24-13-7-10-17(15(22)12-13)29-18-6-4-5-11-23-18/h4-12H,1-3H3,(H,24,25)