2-fluoranyl-N-[2-oxidanyl-1-[5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 2-fluoranyl-N-[2-oxidanyl-1-[5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[4-allyl-5-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[2-hydroxy-1-[5-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 2-fluoro-N-[2-hydroxy-1-[5-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[1-[4-allyl-5-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-fluoro-benzamide Formula: C28H24FN5O3S2 MolecularWeight: 561.650263

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C(CO)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C(CO)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C28H24FN5O3S2/c1-2-15-33-26(20(16-35)30-27(37)18-9-3-4-10-19(18)29)31-32-28(33)38-17-25(36)34-21-11-5-7-13-23(21)39-24-14-8-6-12-22(24)34/h2-14,20,35H,1,15-17H2,(H,30,37)