dimethyl 5-azanyl-3-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[5-(4-fluorophenyl)-1H-imidazol-2-yl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[[5-(4-fluorophenyl)-1H-imidazol-2-yl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H16FN3O4S2 MolecularWeight: 421.465743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CSC2=NC=C(N2)C3=CC=C(C=C3)F)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CSC2=NC=C(N2)C3=CC=C(C=C3)F)C(=O)OC)N

InChI

InChI=1S/C18H16FN3O4S2/c1-25-16(23)13-11(14(17(24)26-2)28-15(13)20)8-27-18-21-7-12(22-18)9-3-5-10(19)6-4-9/h3-7H,8,20H2,1-2H3,(H,21,22)