2-(benzotriazol-1-yl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide CAS Name: 2-(1-benzotriazolyl)-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methylacetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylacetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-acetamide Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C13H16N4O3S/c1-16(10-6-7-21(19,20)9-10)13(18)8-17-12-5-3-2-4-11(12)14-15-17/h2-5,10H,6-9H2,1H3/t10-/m0/s1