5-[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[(4-fluorophenyl)-(2-thienyl)methyl]amino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[[(4-fluorophenyl)-(2-thienyl)methyl]amino]-5-keto-3,3-dimethyl-valeric acid Formula: C18H20FNO3S MolecularWeight: 349.419703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC(C1=CC=C(C=C1)F)C2=CC=CS2)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC(C1=CC=C(C=C1)F)C2=CC=CS2)CC(=O)O

InChI

InChI=1S/C18H20FNO3S/c1-18(2,11-16(22)23)10-15(21)20-17(14-4-3-9-24-14)12-5-7-13(19)8-6-12/h3-9,17H,10-11H2,1-2H3,(H,20,21)(H,22,23)