6-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-fluorophenyl)pyridine-3-carboxamide

Systemtic Name: 6-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-fluorophenyl)pyridine-3-carboxamide Openeye Name: 6-[2-(3-bromoanilino)-2-oxo-ethyl]sulfanyl-N-(4-fluorophenyl)pyridine-3-carboxamide CAS Name: 6-[[2-(3-bromoanilino)-2-oxoethyl]thio]-N-(4-fluorophenyl)-3-pyridinecarboxamide IUPAC Name: 6-[2-(3-bromoanilino)-2-oxoethyl]sulfanyl-N-(4-fluorophenyl)pyridine-3-carboxamide Traditional Name: 6-[[2-(3-bromoanilino)-2-keto-ethyl]thio]-N-(4-fluorophenyl)nicotinamide Formula: C20H15BrFN3O2S MolecularWeight: 460.319403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)CSC2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)CSC2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H15BrFN3O2S/c21-14-2-1-3-17(10-14)24-18(26)12-28-19-9-4-13(11-23-19)20(27)25-16-7-5-15(22)6-8-16/h1-11H,12H2,(H,24,26)(H,25,27)