2-cyclopentyl-2-[[5,5-dimethyl-4-oxidanylidene-2-(thiophen-2-ylmethyl)hexanoyl]amino]ethanoic acid

Systemtic Name: 2-cyclopentyl-2-[[5,5-dimethyl-4-oxidanylidene-2-(thiophen-2-ylmethyl)hexanoyl]amino]ethanoic acid Openeye Name: 2-cyclopentyl-2-[[5,5-dimethyl-4-oxo-2-(2-thienylmethyl)hexanoyl]amino]acetic acid CAS Name: 2-cyclopentyl-2-[[5,5-dimethyl-1,4-dioxo-2-(thiophen-2-ylmethyl)hexyl]amino]acetic acid IUPAC Name: 2-cyclopentyl-2-[[5,5-dimethyl-4-oxo-2-(thiophen-2-ylmethyl)hexanoyl]amino]acetic acid Traditional Name: 2-cyclopentyl-2-[[4-keto-5,5-dimethyl-2-(2-thenyl)hexanoyl]amino]acetic acid Formula: C20H29NO4S MolecularWeight: 379.51356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(CC1=CC=CS1)C(=O)NC(C2CCCC2)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)CC(CC1=CC=CS1)C(=O)NC(C2CCCC2)C(=O)O

InChI

InChI=1S/C20H29NO4S/c1-20(2,3)16(22)12-14(11-15-9-6-10-26-15)18(23)21-17(19(24)25)13-7-4-5-8-13/h6,9-10,13-14,17H,4-5,7-8,11-12H2,1-3H3,(H,21,23)(H,24,25)