2-[[4-(3-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[[4-(3-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholino-ethanone CAS Name: 2-[[4-(3-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[[4-(3-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[[4-(3-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-morpholino-ethanone Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H19ClN4O2S/c21-16-7-4-8-17(13-16)25-19(15-5-2-1-3-6-15)22-23-20(25)28-14-18(26)24-9-11-27-12-10-24/h1-8,13H,9-12,14H2