N-(1,3-benzodioxol-5-ylmethyl)-2-[1,3-benzothiazol-2-yl-(4-ethanoylphenyl)amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1,3-benzothiazol-2-yl-(4-ethanoylphenyl)amino]ethanamide Openeye Name: 2-[4-acetyl-N-(1,3-benzothiazol-2-yl)anilino]-N-(1,3-benzodioxol-5-ylmethyl)acetamide CAS Name: 2-[4-acetyl-N-(1,3-benzothiazol-2-yl)anilino]-N-(1,3-benzodioxol-5-ylmethyl)acetamide IUPAC Name: 2-[4-acetyl-N-(1,3-benzothiazol-2-yl)anilino]-N-(1,3-benzodioxol-5-ylmethyl)acetamide Traditional Name: 2-[4-acetyl-N-(1,3-benzothiazol-2-yl)anilino]-N-piperonyl-acetamide Formula: C25H21N3O4S MolecularWeight: 459.51694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H21N3O4S/c1-16(29)18-7-9-19(10-8-18)28(25-27-20-4-2-3-5-23(20)33-25)14-24(30)26-13-17-6-11-21-22(12-17)32-15-31-21/h2-12H,13-15H2,1H3,(H,26,30)