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

Systemtic Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-2-phenyl-ethanone Openeye Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholino-2-phenyl-ethanone CAS Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(4-morpholinyl)-2-phenylethanone IUPAC Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-2-phenylethanone Traditional Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-morpholino-2-phenyl-ethanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC(C3=CC=CC=C3)C(=O)N4CCOCC4

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)S[C@H](C3=CC=CC=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C21H22N4O2S/c1-16-22-23-21(25(16)18-10-6-3-7-11-18)28-19(17-8-4-2-5-9-17)20(26)24-12-14-27-15-13-24/h2-11,19H,12-15H2,1H3/t19-/m1/s1