N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[(4-fluorophenyl)methylsulfanylmethyl]thiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[(4-fluorophenyl)methylthio]methyl]-2-thiazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[[(4-fluorobenzyl)thio]methyl]thiazol-2-yl]-piperonylamide Formula: C19H15FN2O3S2 MolecularWeight: 402.462403

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NC(=CS3)CSCC4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NC(=CS3)CSCC4=CC=C(C=C4)F

InChI

InChI=1S/C19H15FN2O3S2/c20-14-4-1-12(2-5-14)8-26-9-15-10-27-19(21-15)22-18(23)13-3-6-16-17(7-13)25-11-24-16/h1-7,10H,8-9,11H2,(H,21,22,23)