(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]acetic 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 2-[(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-(tosylamino)acetic 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:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C16H15N3O5S2/c1-10-2-4-11(5-3-10)26(22,23)17-8-14(20)24-9-13-18-12-6-7-25-15(12)16(21)19-13/h2-7,17H,8-9H2,1H3,(H,18,19,21)