N4-(cyclopropylmethyl)-3-[(4-fluorophenyl)sulfanylmethyl]-N5-propyl-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4-(cyclopropylmethyl)-3-[(4-fluorophenyl)sulfanylmethyl]-N5-propyl-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4-(cyclopropylmethyl)-3-[(4-fluorophenyl)sulfanylmethyl]-N5-propyl-isoxazole-4,5-dicarboxamide CAS Name: N4-(cyclopropylmethyl)-3-[[(4-fluorophenyl)thio]methyl]-N5-propylisoxazole-4,5-dicarboxamide IUPAC Name: 4-N-(cyclopropylmethyl)-3-[(4-fluorophenyl)sulfanylmethyl]-5-N-propyl-1,2-oxazole-4,5-dicarboxamide Traditional Name: N-(cyclopropylmethyl)-3-[[(4-fluorophenyl)thio]methyl]-N'-propyl-isoxazole-4,5-dicarboxamide Formula: C19H22FN3O3S MolecularWeight: 391.459683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C(=NO1)CSC2=CC=C(C=C2)F)C(=O)NCC3CC3

Isomeric SMILES

CCCNC(=O)C1=C(C(=NO1)CSC2=CC=C(C=C2)F)C(=O)NCC3CC3

InChI

InChI=1S/C19H22FN3O3S/c1-2-9-21-19(25)17-16(18(24)22-10-12-3-4-12)15(23-26-17)11-27-14-7-5-13(20)6-8-14/h5-8,12H,2-4,9-11H2,1H3,(H,21,25)(H,22,24)