1-[2-(aminomethyl)phenyl]-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-methanesulfonamide

Systemtic Name: 1-[2-(aminomethyl)phenyl]-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-methanesulfonamide Openeye Name: 1-[2-(aminomethyl)phenyl]-N-(1,1-dioxothiolan-3-yl)-N-methyl-methanesulfonamide CAS Name: 1-[2-(aminomethyl)phenyl]-N-(1,1-dioxo-3-thiolanyl)-N-methylmethanesulfonamide IUPAC Name: 1-[2-(aminomethyl)phenyl]-N-(1,1-dioxothiolan-3-yl)-N-methylmethanesulfonamide Traditional Name: 1-[2-(aminomethyl)phenyl]-N-(1,1-diketothiolan-3-yl)-N-methyl-methanesulfonamide Formula: C13H20N2O4S2 MolecularWeight: 332.4389

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)S(=O)(=O)CC2=CC=CC=C2CN

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)S(=O)(=O)CC2=CC=CC=C2CN

InChI

InChI=1S/C13H20N2O4S2/c1-15(13-6-7-20(16,17)10-13)21(18,19)9-12-5-3-2-4-11(12)8-14/h2-5,13H,6-10,14H2,1H3