N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-phosphonato-ethanamide

Systemtic Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-phosphonato-ethanamide Openeye Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-phosphonato-acetamide CAS Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-phosphonatoacetamide IUPAC Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-phosphonatoacetamide Traditional Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-phosphonato-acetamide Formula: C17H15N2O6PS-2 MolecularWeight: 406.349561

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)SC(=N2)NC(=O)C(C3=CC=CC=C3)P(=O)([O-])[O-])OC

Isomeric SMILES

COC1=CC(=C2C(=C1)SC(=N2)NC(=O)C(C3=CC=CC=C3)P(=O)([O-])[O-])OC

InChI

InChI=1S/C17H17N2O6PS/c1-24-11-8-12(25-2)14-13(9-11)27-17(18-14)19-16(20)15(26(21,22)23)10-6-4-3-5-7-10/h3-9,15H,1-2H3,(H,18,19,20)(H2,21,22,23)/p-2