N-[2-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[2-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[2-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazol-6-yl]acetamide Formula: C20H23N2O4PS MolecularWeight: 418.446381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)NC(=O)C)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)NC(=O)C)OCC

InChI

InChI=1S/C20H23N2O4PS/c1-4-25-27(24,26-5-2)13-15-6-8-16(9-7-15)20-22-18-11-10-17(21-14(3)23)12-19(18)28-20/h6-12H,4-5,13H2,1-3H3,(H,21,23)