2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-propanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-propanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)-N-ethyl-propanamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(1,1-dioxo-3-thiolanyl)-N-ethylpropanamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)-N-ethylpropanamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(1,1-diketothiolan-3-yl)-N-ethyl-propionamide Formula: C18H24N4O3S2 MolecularWeight: 408.53816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C(=O)C(C)SC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

CCN(C1CCS(=O)(=O)C1)C(=O)C(C)SC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C18H24N4O3S2/c1-3-21(15-9-10-27(24,25)12-15)17(23)13(2)26-18-20-16(11-22(18)19)14-7-5-4-6-8-14/h4-8,11,13,15H,3,9-10,12,19H2,1-2H3