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

Systemtic Name: 2-[[4-cyclohexyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[[4-cyclohexyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholino-ethanone CAS Name: 2-[[4-cyclohexyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[[4-cyclohexyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[[4-cyclohexyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]-1-morpholino-ethanone Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)N4CCOCC4

InChI

InChI=1S/C21H28N4O2S/c1-16-6-5-7-17(14-16)20-22-23-21(25(20)18-8-3-2-4-9-18)28-15-19(26)24-10-12-27-13-11-24/h5-7,14,18H,2-4,8-13,15H2,1H3