N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanylimidazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-(methylthio)imidazole-4-carboxamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

Isomeric SMILES

CN(CC1COC2=CC=CC=C2O1)C(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

InChI

InChI=1S/C21H20FN3O3S/c1-24(12-16-13-27-18-5-3-4-6-19(18)28-16)20(26)17-11-23-21(29-2)25(17)15-9-7-14(22)8-10-15/h3-11,16H,12-13H2,1-2H3