(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-pyrrol-1-ylthiophene-2-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-pyrrol-1-ylthiophene-2-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3-pyrrol-1-ylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolyl)-2-thiophenecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 3-pyrrol-1-ylthiophene-2-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=C(C=CS2)N3C=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=C(C=CS2)N3C=CC=C3

InChI

InChI=1S/C17H14N2O3S/c18-16(20)14(12-6-2-1-3-7-12)22-17(21)15-13(8-11-23-15)19-9-4-5-10-19/h1-11,14H,(H2,18,20)