2-fluoranyl-N-[2-oxidanyl-1-[5-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 2-fluoranyl-N-[2-oxidanyl-1-[5-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[5-(3-anilino-3-oxo-propyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-fluoro-benzamide CAS Name: N-[1-[5-[(3-anilino-3-oxopropyl)thio]-4-phenyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-2-fluorobenzamide IUPAC Name: N-[1-[5-(3-anilino-3-oxopropyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-2-fluorobenzamide Traditional Name: N-[1-[5-[(3-anilino-3-keto-propyl)thio]-4-phenyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-fluoro-benzamide Formula: C26H24FN5O3S MolecularWeight: 505.563863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)C(CO)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)C(CO)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C26H24FN5O3S/c27-21-14-8-7-13-20(21)25(35)29-22(17-33)24-30-31-26(32(24)19-11-5-2-6-12-19)36-16-15-23(34)28-18-9-3-1-4-10-18/h1-14,22,33H,15-17H2,(H,28,34)(H,29,35)