4,5,6-trimethyl-2-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: 4,5,6-trimethyl-2-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: 4,5,6-trimethyl-2-[(1S)-2-morpholino-2-oxo-1-phenyl-ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: 4,5,6-trimethyl-2-[[(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]thio]-3-pyridinecarboxamide IUPAC Name: 4,5,6-trimethyl-2-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[[(1S)-2-keto-2-morpholino-1-phenyl-ethyl]thio]-4,5,6-trimethyl-nicotinamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C(=O)N)SC(C2=CC=CC=C2)C(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C(=O)N)S[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3)C

InChI

InChI=1S/C21H25N3O3S/c1-13-14(2)17(19(22)25)20(23-15(13)3)28-18(16-7-5-4-6-8-16)21(26)24-9-11-27-12-10-24/h4-8,18H,9-12H2,1-3H3,(H2,22,25)/t18-/m0/s1