N-[4-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: N-[4-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]benzamide Openeye Name: N-[4-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]thiazol-2-yl]benzamide CAS Name: N-[4-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-2-thiazolyl]benzamide IUPAC Name: N-[4-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-[3-keto-3-(piperonylamino)propyl]thiazol-2-yl]benzamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC3=CSC(=N3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC3=CSC(=N3)NC(=O)C4=CC=CC=C4

InChI

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