2-(2-cyanoethanoylamino)-4-(2-phenylcyclopropyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(2-cyanoethanoylamino)-4-(2-phenylcyclopropyl)thiophene-3-carboxylic acid Openeye Name: 2-[(2-cyanoacetyl)amino]-4-(2-phenylcyclopropyl)thiophene-3-carboxylic acid CAS Name: 2-[(2-cyano-1-oxoethyl)amino]-4-(2-phenylcyclopropyl)-3-thiophenecarboxylic acid IUPAC Name: 2-[(2-cyanoacetyl)amino]-4-(2-phenylcyclopropyl)thiophene-3-carboxylic acid Traditional Name: 2-[(2-cyanoacetyl)amino]-4-(2-phenylcyclopropyl)-3-thenoic acid Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C2=CSC(=C2C(=O)O)NC(=O)CC#N)C3=CC=CC=C3

Isomeric SMILES

C1C(C1C2=CSC(=C2C(=O)O)NC(=O)CC#N)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O3S/c18-7-6-14(20)19-16-15(17(21)22)13(9-23-16)12-8-11(12)10-4-2-1-3-5-10/h1-5,9,11-12H,6,8H2,(H,19,20)(H,21,22)