5-tert-butyl-3-[(1-ethylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-tert-butyl-3-[(1-ethylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylic acid Openeye Name: 5-tert-butyl-3-[(1-ethylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylic acid CAS Name: 5-tert-butyl-3-[[[(1-ethyl-3-pyrrolyl)amino]-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-tert-butyl-3-[(1-ethylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylic acid Traditional Name: 5-tert-butyl-3-[(1-ethylpyrrol-3-yl)carbamoylamino]-2-thenoic acid Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=C1)NC(=O)NC2=C(SC(=C2)C(C)(C)C)C(=O)O

Isomeric SMILES

CCN1C=CC(=C1)NC(=O)NC2=C(SC(=C2)C(C)(C)C)C(=O)O

InChI

InChI=1S/C16H21N3O3S/c1-5-19-7-6-10(9-19)17-15(22)18-11-8-12(16(2,3)4)23-13(11)14(20)21/h6-9H,5H2,1-4H3,(H,20,21)(H2,17,18,22)