2-[4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]amino]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]amino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[[(1,1-dioxothiolan-3-yl)amino]methyl]phenoxy]acetonitrile CAS Name: 2-[4-[[(1,1-dioxo-3-thiolanyl)amino]methyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[[(1,1-dioxothiolan-3-yl)amino]methyl]phenoxy]acetonitrile Traditional Name: 2-[4-[[(1,1-diketothiolan-3-yl)amino]methyl]phenoxy]acetonitrile Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NCC2=CC=C(C=C2)OCC#N

Isomeric SMILES

C1CS(=O)(=O)CC1NCC2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C13H16N2O3S/c14-6-7-18-13-3-1-11(2-4-13)9-15-12-5-8-19(16,17)10-12/h1-4,12,15H,5,7-10H2