N-[4-fluoranyl-3-[[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-fluoranyl-3-[[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-fluoro-3-[[2-oxo-2-(2-thienylmethylamino)ethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-fluoro-3-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-fluoro-3-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-fluoro-3-[[2-keto-2-(2-thenylamino)ethyl]amino]phenyl]-piperonylamide Formula: C21H18FN3O4S MolecularWeight: 427.448723

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)NCC(=O)NCC4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)NCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H18FN3O4S/c22-16-5-4-14(25-21(27)13-3-6-18-19(8-13)29-12-28-18)9-17(16)23-11-20(26)24-10-15-2-1-7-30-15/h1-9,23H,10-12H2,(H,24,26)(H,25,27)