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

Systemtic Name: 2-(benzotriazol-1-yl)-N-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-(1,1-dioxothiolan-3-yl)acetamide CAS Name: 2-(1-benzotriazolyl)-N-(1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-(1,1-dioxothiolan-3-yl)acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-(1,1-diketothiolan-3-yl)acetamide Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H14N4O3S/c17-12(13-9-5-6-20(18,19)8-9)7-16-11-4-2-1-3-10(11)14-15-16/h1-4,9H,5-8H2,(H,13,17)