3-(1,3-benzothiazol-2-yl)-N-[(2-ethoxypyridin-3-yl)methyl]-2-methyl-2-phenyl-propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(2-ethoxypyridin-3-yl)methyl]-2-methyl-2-phenyl-propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(2-ethoxy-3-pyridyl)methyl]-2-methyl-2-phenyl-propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(2-ethoxy-3-pyridinyl)methyl]-2-methyl-2-phenylpropanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(2-ethoxypyridin-3-yl)methyl]-2-methyl-2-phenylpropanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(2-ethoxy-3-pyridyl)methyl]-2-methyl-2-phenyl-propionamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CNC(=O)C(C)(CC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC=N1)CNC(=O)C(C)(CC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2S/c1-3-30-23-18(10-9-15-26-23)17-27-24(29)25(2,19-11-5-4-6-12-19)16-22-28-20-13-7-8-14-21(20)31-22/h4-15H,3,16-17H2,1-2H3,(H,27,29)