2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methylacetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylacetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-acetamide Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)CSC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O3S2/c1-19(13-7-8-25(22,23)11-13)15(21)10-24-16-18-14(9-20(16)17)12-5-3-2-4-6-12/h2-6,9,13H,7-8,10-11,17H2,1H3/t13-/m0/s1