N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-(4-ethylphenyl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-(4-ethylphenyl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-(4-ethylphenyl)-N-(3-pyridylmethyl)acetamide CAS Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-(4-ethylphenyl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-(4-ethylphenyl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-(4-ethylphenyl)-N-(3-pyridylmethyl)acetamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)CC(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)OCC

InChI

InChI=1S/C25H25N3O2S/c1-3-18-10-12-19(13-11-18)15-23(29)28(17-20-7-6-14-26-16-20)25-27-24-21(30-4-2)8-5-9-22(24)31-25/h5-14,16H,3-4,15,17H2,1-2H3