4-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one Openeye Name: 4-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]sulfanyl]-1-(2-thienyl)butan-1-one CAS Name: 4-[[4-(3-fluorophenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]thio]-1-(2-thienyl)butan-1-one Formula: C20H21FN4O2S2 MolecularWeight: 432.534743

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(N2C3=CC(=CC=C3)F)SCCCC(=O)C4=CC=CS4

Isomeric SMILES

C1COCCN1C2=NN=C(N2C3=CC(=CC=C3)F)SCCCC(=O)C4=CC=CS4

InChI

InChI=1S/C20H21FN4O2S2/c21-15-4-1-5-16(14-15)25-19(24-8-10-27-11-9-24)22-23-20(25)29-13-2-6-17(26)18-7-3-12-28-18/h1,3-5,7,12,14H,2,6,8-11,13H2