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

Systemtic Name: (2S)-1-morpholin-4-yl-2-phenyl-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: (2S)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-morpholino-2-phenyl-ethanone CAS Name: (2S)-1-(4-morpholinyl)-2-phenyl-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: (2S)-1-morpholin-4-yl-2-phenyl-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: (2S)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]-1-morpholino-2-phenyl-ethanone Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SC(C2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC(C)C1=NC(=NN1)S[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C17H22N4O2S/c1-12(2)15-18-17(20-19-15)24-14(13-6-4-3-5-7-13)16(22)21-8-10-23-11-9-21/h3-7,12,14H,8-11H2,1-2H3,(H,18,19,20)/t14-/m0/s1