2-(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)-N-(5-pyridin-4-ylthiophen-3-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)-N-(5-pyridin-4-ylthiophen-3-yl)ethanamide Openeye Name: 2-(2-bromo-4-hydroxy-5-methoxy-phenyl)-N-[5-(4-pyridyl)-3-thienyl]acetamide CAS Name: 2-(2-bromo-4-hydroxy-5-methoxyphenyl)-N-(5-pyridin-4-yl-3-thiophenyl)acetamide IUPAC Name: 2-(2-bromo-4-hydroxy-5-methoxyphenyl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide Traditional Name: 2-(2-bromo-4-hydroxy-5-methoxy-phenyl)-N-[5-(4-pyridyl)-3-thienyl]acetamide Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)NC2=CSC(=C2)C3=CC=NC=C3)Br)O

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)NC2=CSC(=C2)C3=CC=NC=C3)Br)O

InChI

InChI=1S/C18H15BrN2O3S/c1-24-16-6-12(14(19)9-15(16)22)7-18(23)21-13-8-17(25-10-13)11-2-4-20-5-3-11/h2-6,8-10,22H,7H2,1H3,(H,21,23)