N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]thiazol-2-yl]-2-phenyl-acetamide CAS Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-2-thiazolyl]-2-phenylacetamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-1,3-thiazol-2-yl]-2-phenylacetamide Traditional Name: N-[4-[2-keto-2-(piperonylamino)ethyl]thiazol-2-yl]-2-phenyl-acetamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=CSC(=N3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=CSC(=N3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O4S/c25-19(22-11-15-6-7-17-18(8-15)28-13-27-17)10-16-12-29-21(23-16)24-20(26)9-14-4-2-1-3-5-14/h1-8,12H,9-11,13H2,(H,22,25)(H,23,24,26)