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

Systemtic Name: (2R)-2-[(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]cyclohexan-1-one Openeye Name: (2R)-2-[(5-morpholino-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]cyclohexanone CAS Name: (2R)-2-[[5-(4-morpholinyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-cyclohexanone IUPAC Name: (2R)-2-[(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]cyclohexan-1-one Traditional Name: (2R)-2-[(5-morpholino-4-phenyl-1,2,4-triazol-3-yl)thio]cyclohexanone Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)SC2=NN=C(N2C3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

C1CCC(=O)[C@@H](C1)SC2=NN=C(N2C3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C18H22N4O2S/c23-15-8-4-5-9-16(15)25-18-20-19-17(21-10-12-24-13-11-21)22(18)14-6-2-1-3-7-14/h1-3,6-7,16H,4-5,8-13H2/t16-/m1/s1