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

Systemtic Name: 2-[[5-(3-methylphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[[4-isopropyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholino-ethanone CAS Name: 2-[[5-(3-methylphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[[5-(3-methylphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[[4-isopropyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]-1-morpholino-ethanone Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2C(C)C)SCC(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C(C)C)SCC(=O)N3CCOCC3

InChI

InChI=1S/C18H24N4O2S/c1-13(2)22-17(15-6-4-5-14(3)11-15)19-20-18(22)25-12-16(23)21-7-9-24-10-8-21/h4-6,11,13H,7-10,12H2,1-3H3