N-[1-(3-acetamidophenyl)ethyl]-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carboxamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carboxamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H21FN4O2S/c1-13(15-5-4-6-17(11-15)25-14(2)27)24-20(28)19-12-23-21(29-3)26(19)18-9-7-16(22)8-10-18/h4-13H,1-3H3,(H,24,28)(H,25,27)