N-(ethylcarbamoyl)-2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(ethylcarbamoyl)-2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(ethylcarbamoyl)-2-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(ethylcarbamoyl)-2-[[4-(3-fluorophenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(ethylcarbamoyl)-2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(ethylcarbamoyl)-2-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H21FN6O3S MolecularWeight: 408.450443

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)CSC1=NN=C(N1C2=CC(=CC=C2)F)N3CCOCC3

Isomeric SMILES

CCNC(=O)NC(=O)CSC1=NN=C(N1C2=CC(=CC=C2)F)N3CCOCC3

InChI

InChI=1S/C17H21FN6O3S/c1-2-19-15(26)20-14(25)11-28-17-22-21-16(23-6-8-27-9-7-23)24(17)13-5-3-4-12(18)10-13/h3-5,10H,2,6-9,11H2,1H3,(H2,19,20,25,26)