[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 4-(1H-imidazol-2-yl)benzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 4-(1H-imidazol-2-yl)benzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 4-(1H-imidazol-2-yl)benzoate CAS Name: 4-(1H-imidazol-2-yl)benzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 4-(1H-imidazol-2-yl)benzoate Traditional Name: 4-(1H-imidazol-2-yl)benzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C17H15N3O3S MolecularWeight: 341.3843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC(=O)COC(=O)C2=CC=C(C=C2)C3=NC=CN3

Isomeric SMILES

C1=CSC(=C1)CNC(=O)COC(=O)C2=CC=C(C=C2)C3=NC=CN3

InChI

InChI=1S/C17H15N3O3S/c21-15(20-10-14-2-1-9-24-14)11-23-17(22)13-5-3-12(4-6-13)16-18-7-8-19-16/h1-9H,10-11H2,(H,18,19)(H,20,21)