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

Systemtic Name: 5-[[3-cyano-4-(4-fluorophenyl)-5-methyl-thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[3-cyano-4-(4-fluorophenyl)-5-methyl-2-thienyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[3-cyano-4-(4-fluorophenyl)-5-methyl-2-thiophenyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[3-cyano-4-(4-fluorophenyl)-5-methylthiophen-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[3-cyano-4-(4-fluorophenyl)-5-methyl-2-thienyl]amino]-5-keto-valeric acid Formula: C17H15FN2O3S MolecularWeight: 346.376003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCCC(=O)O)C#N)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCCC(=O)O)C#N)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H15FN2O3S/c1-10-16(11-5-7-12(18)8-6-11)13(9-19)17(24-10)20-14(21)3-2-4-15(22)23/h5-8H,2-4H2,1H3,(H,20,21)(H,22,23)