6-[2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[[4-ethyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)C2=CC3=C(C=C2)OCC(=O)N3)N4CCOCC4

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)C2=CC3=C(C=C2)OCC(=O)N3)N4CCOCC4

InChI

InChI=1S/C19H23N5O4S/c1-3-24-18(23-6-8-27-9-7-23)21-22-19(24)29-12(2)17(26)13-4-5-15-14(10-13)20-16(25)11-28-15/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,20,25)