2-[4-[[1,1-bis(oxidanylidene)thian-4-yl]amino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[[1,1-bis(oxidanylidene)thian-4-yl]amino]phenyl]ethanenitrile Openeye Name: 2-[4-[(1,1-dioxothian-4-yl)amino]phenyl]acetonitrile CAS Name: 2-[4-[(1,1-dioxo-4-thianyl)amino]phenyl]acetonitrile IUPAC Name: 2-[4-[(1,1-dioxothian-4-yl)amino]phenyl]acetonitrile Traditional Name: 2-[4-[(1,1-diketothian-4-yl)amino]phenyl]acetonitrile Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC=C(C=C2)CC#N

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C13H16N2O2S/c14-8-5-11-1-3-12(4-2-11)15-13-6-9-18(16,17)10-7-13/h1-4,13,15H,5-7,9-10H2