N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)-N-piperonyl-imidazole-4-carboxamide Formula: C19H16FN3O3S MolecularWeight: 385.412043

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16FN3O3S/c1-27-19-22-10-15(23(19)14-5-3-13(20)4-6-14)18(24)21-9-12-2-7-16-17(8-12)26-11-25-16/h2-8,10H,9,11H2,1H3,(H,21,24)