3-(4-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propanamide Openeye Name: 3-(4-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propanamide CAS Name: 3-[(4-fluorophenyl)thio]-N-[(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]propanamide IUPAC Name: 3-(4-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propionamide Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)OC)NC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)OC)NC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O2S/c1-25-13-12-23-21(25)20(15-3-7-17(27-2)8-4-15)24-19(26)11-14-28-18-9-5-16(22)6-10-18/h3-10,12-13,20H,11,14H2,1-2H3,(H,24,26)