6-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-1-oxo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]propyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3O4S/c1-11(27-19-22-21-18(26-19)12-5-3-2-4-6-12)17(24)13-7-8-15-14(9-13)20-16(23)10-25-15/h2-9,11H,10H2,1H3,(H,20,23)/t11-/m0/s1