5-[2-cyanoethyl(phenyl)carbamoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[2-cyanoethyl(phenyl)carbamoyl]thiophene-2-carboxylic acid Openeye Name: 5-[2-cyanoethyl(phenyl)carbamoyl]thiophene-2-carboxylic acid CAS Name: 5-[[N-(2-cyanoethyl)anilino]-oxomethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[2-cyanoethyl(phenyl)carbamoyl]thiophene-2-carboxylic acid Traditional Name: 5-[2-cyanoethyl(phenyl)carbamoyl]-2-thenoic acid Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)C2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)C2=CC=C(S2)C(=O)O

InChI

InChI=1S/C15H12N2O3S/c16-9-4-10-17(11-5-2-1-3-6-11)14(18)12-7-8-13(21-12)15(19)20/h1-3,5-8H,4,10H2,(H,19,20)