(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(phenylsulfonylamino)propanoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(phenylsulfonylamino)propanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C16H15N3O5S2 MolecularWeight: 393.4374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C16H15N3O5S2/c20-14(6-8-17-26(22,23)11-4-2-1-3-5-11)24-10-13-18-12-7-9-25-15(12)16(21)19-13/h1-5,7,9,17H,6,8,10H2,(H,18,19,21)