N-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Formula: C19H21N2O4PS MolecularWeight: 404.419801

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CS3)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CS3)OCC

InChI

InChI=1S/C19H21N2O4PS/c1-3-24-26(23,25-4-2)12-14-5-8-16(9-6-14)21-19(22)15-7-10-17-18(11-15)27-13-20-17/h5-11,13H,3-4,12H2,1-2H3,(H,21,22)