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

Systemtic Name: 2-fluoranyl-N-[[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[[4-allyl-5-(2-morpholino-2-oxo-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[[5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-fluoro-N-[[5-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: N-[[4-allyl-5-[(2-keto-2-morpholino-ethyl)thio]-1,2,4-triazol-3-yl]methyl]-2-fluoro-benzamide Formula: C19H22FN5O3S MolecularWeight: 419.473083

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)N2CCOCC2)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)N2CCOCC2)CNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H22FN5O3S/c1-2-7-25-16(12-21-18(27)14-5-3-4-6-15(14)20)22-23-19(25)29-13-17(26)24-8-10-28-11-9-24/h2-6H,1,7-13H2,(H,21,27)