(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(2R)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(2R)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[(2R)-3-keto-4H-1,4-benzoxazin-2-yl]acetic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(O2)CC(=O)OCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)[C@H](O2)CC(=O)OCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C17H13N3O5S/c21-15(7-13-17(22)18-11-3-1-2-4-12(11)24-13)23-8-14-19-16(20-25-14)10-5-6-26-9-10/h1-6,9,13H,7-8H2,(H,18,22)/t13-/m1/s1