5-[[4-ethyl-5-methyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-ethyl-5-methyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[4-ethyl-5-methyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[4-ethyl-5-methyl-3-[oxo-(3-pyridinylmethylamino)methyl]-2-thiophenyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[4-ethyl-5-methyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[4-ethyl-5-methyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]amino]-5-keto-valeric acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)CCCC(=O)O)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)CCCC(=O)O)C

InChI

InChI=1S/C19H23N3O4S/c1-3-14-12(2)27-19(22-15(23)7-4-8-16(24)25)17(14)18(26)21-11-13-6-5-9-20-10-13/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,21,26)(H,22,23)(H,24,25)