N-(4-chloranyl-1,3-benzothiazol-2-yl)-4-(diethoxyphosphorylmethyl)benzamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-4-(diethoxyphosphorylmethyl)benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-(diethoxyphosphorylmethyl)benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-(diethoxyphosphorylmethyl)benzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-(diethoxyphosphorylmethyl)benzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-(diethoxyphosphorylmethyl)benzamide Formula: C19H20ClN2O4PS MolecularWeight: 438.864861

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC=C3Cl)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC=C3Cl)OCC

InChI

InChI=1S/C19H20ClN2O4PS/c1-3-25-27(24,26-4-2)12-13-8-10-14(11-9-13)18(23)22-19-21-17-15(20)6-5-7-16(17)28-19/h5-11H,3-4,12H2,1-2H3,(H,21,22,23)