2-[(4-pyrrol-1-ylphenyl)carbonylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[(4-pyrrol-1-ylphenyl)carbonylamino]-1,3-thiazole-4-carboxylate Openeye Name: 2-[(4-pyrrol-1-ylbenzoyl)amino]thiazole-4-carboxylate CAS Name: 2-[[oxo-[4-(1-pyrrolyl)phenyl]methyl]amino]-4-thiazolecarboxylate IUPAC Name: 2-[(4-pyrrol-1-ylbenzoyl)amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(4-pyrrol-1-ylbenzoyl)amino]thiazole-4-carboxylate Formula: C15H10N3O3S- MolecularWeight: 312.3232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C(=O)[O-]

Isomeric SMILES

C1=CN(C=C1)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C(=O)[O-]

InChI

InChI=1S/C15H11N3O3S/c19-13(17-15-16-12(9-22-15)14(20)21)10-3-5-11(6-4-10)18-7-1-2-8-18/h1-9H,(H,20,21)(H,16,17,19)/p-1