N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-1-pyridin-4-yl-ethyl]-5-oxidanylidene-N-phenyl-thiolane-3-carboxamide

Systemtic Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-1-pyridin-4-yl-ethyl]-5-oxidanylidene-N-phenyl-thiolane-3-carboxamide Openeye Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxo-1-(4-pyridyl)ethyl]-5-oxo-N-phenyl-tetrahydrothiophene-3-carboxamide CAS Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxo-1-pyridin-4-ylethyl]-5-oxo-N-phenyl-3-thiolanecarboxamide IUPAC Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxo-1-pyridin-4-ylethyl]-5-oxo-N-phenylthiolane-3-carboxamide Traditional Name: N-[2-[(4-fluorobenzyl)amino]-2-keto-1-(4-pyridyl)ethyl]-5-keto-N-phenyl-tetrahydrothiophene-3-carboxamide Formula: C25H22FN3O3S MolecularWeight: 463.523883

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CSC1=O)C(=O)N(C2=CC=CC=C2)C(C3=CC=NC=C3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1C(CSC1=O)C(=O)N(C2=CC=CC=C2)C(C3=CC=NC=C3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O3S/c26-20-8-6-17(7-9-20)15-28-24(31)23(18-10-12-27-13-11-18)29(21-4-2-1-3-5-21)25(32)19-14-22(30)33-16-19/h1-13,19,23H,14-16H2,(H,28,31)