2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxidanylidenethiolan-3-yl]benzamide

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxidanylidenethiolan-3-yl]benzamide Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxotetrahydrothiophen-3-yl]benzamide CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-N-[(3S)-2-oxo-3-thiolanyl]benzamide IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxothiolan-3-yl]benzamide Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-ketotetrahydrothiophen-3-yl]benzamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)NC3CCSC3=O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)N[C@H]3CCSC3=O)OC

InChI

InChI=1S/C17H17N3O5S/c1-23-13-9-14(24-2)20-17(19-13)25-12-6-4-3-5-10(12)15(21)18-11-7-8-26-16(11)22/h3-6,9,11H,7-8H2,1-2H3,(H,18,21)/t11-/m0/s1