4-[[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]benzenecarbonitrile Openeye Name: 4-[(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]benzonitrile CAS Name: 4-[(1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]benzonitrile IUPAC Name: 4-[(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]benzonitrile Traditional Name: 4-[(1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)amino]benzonitrile Formula: C16H14N2O2S MolecularWeight: 298.35956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)C2=CC=CC=C2C1NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CS(=O)(=O)C2=CC=CC=C2C1NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H14N2O2S/c17-11-12-5-7-13(8-6-12)18-15-9-10-21(19,20)16-4-2-1-3-14(15)16/h1-8,15,18H,9-10H2