N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4-fluorophenyl)-N-methyl-2-methylsulfanylimidazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-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(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

InChI

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