N-[(4-fluorophenyl)methyl]-5-[[(4-methylphenyl)methyl-thiophen-2-ylcarbonyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-[[(4-methylphenyl)methyl-thiophen-2-ylcarbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-5-[[p-tolylmethyl(thiophene-2-carbonyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-5-[[(4-methylphenyl)methyl-[oxo(thiophen-2-yl)methyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-5-[[(4-methylphenyl)methyl-(thiophene-2-carbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(4-fluorobenzyl)-5-[[(4-methylbenzyl)-(2-thenoyl)amino]methyl]isoxazole-3-carboxamide Formula: C25H22FN3O3S MolecularWeight: 463.523883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC(=NO2)C(=O)NCC3=CC=C(C=C3)F)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC(=NO2)C(=O)NCC3=CC=C(C=C3)F)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H22FN3O3S/c1-17-4-6-19(7-5-17)15-29(25(31)23-3-2-12-33-23)16-21-13-22(28-32-21)24(30)27-14-18-8-10-20(26)11-9-18/h2-13H,14-16H2,1H3,(H,27,30)