2-(pyridin-4-ylcarbonylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylic acid

Systemtic Name: 2-(pyridin-4-ylcarbonylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylic acid Openeye Name: 2-(pyridine-4-carbonylamino)-4-tetralin-6-yl-thiophene-3-carboxylic acid CAS Name: 2-[[oxo(pyridin-4-yl)methyl]amino]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)-3-thiophenecarboxylic acid IUPAC Name: 2-(pyridine-4-carbonylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylic acid Traditional Name: 2-isonicotinamido-4-tetralin-6-yl-3-thenoic acid Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C3=CSC(=C3C(=O)O)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C3=CSC(=C3C(=O)O)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H18N2O3S/c24-19(14-7-9-22-10-8-14)23-20-18(21(25)26)17(12-27-20)16-6-5-13-3-1-2-4-15(13)11-16/h5-12H,1-4H2,(H,23,24)(H,25,26)