N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-1,3-oxazol-5-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-1,3-oxazol-5-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-oxazol-5-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-5-oxazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-1,3-oxazol-5-amine Traditional Name: [4-(4-fluorophenyl)sulfonyl-2-p-phenetyl-oxazol-5-yl]-piperonyl-amine Formula: C25H21FN2O6S MolecularWeight: 496.507443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H21FN2O6S/c1-2-31-19-8-4-17(5-9-19)23-28-25(35(29,30)20-10-6-18(26)7-11-20)24(34-23)27-14-16-3-12-21-22(13-16)33-15-32-21/h3-13,27H,2,14-15H2,1H3