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

Systemtic Name: 2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[4-methyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-phenylethanone IUPAC Name: 2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)thio]-1-phenyl-ethanone Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C15H18N4O2S/c1-18-14(19-7-9-21-10-8-19)16-17-15(18)22-11-13(20)12-5-3-2-4-6-12/h2-6H,7-11H2,1H3