4-[1-oxidanyl-2-[4-(5-oxidanylidene-4H-1,3,4-thiadiazin-2-yl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-oxidanyl-2-[4-(5-oxidanylidene-4H-1,3,4-thiadiazin-2-yl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzenecarbonitrile Openeye Name: 4-[1-hydroxy-2-[4-(5-oxo-4H-1,3,4-thiadiazin-2-yl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzonitrile CAS Name: 4-[1-hydroxy-2-[4-(5-oxo-4H-1,3,4-thiadiazin-2-yl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzonitrile IUPAC Name: 4-[1-hydroxy-2-[4-(5-oxo-4H-1,3,4-thiadiazin-2-yl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzonitrile Traditional Name: 4-[1-hydroxy-2-[4-(5-keto-4H-1,3,4-thiadiazin-2-yl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzonitrile Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C=CC1C2=NNC(=O)CS2)CC(C3=CC=C(C=C3)C#N)O

Isomeric SMILES

C1CN(C=CC1C2=NNC(=O)CS2)CC(C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C17H18N4O2S/c18-9-12-1-3-13(4-2-12)15(22)10-21-7-5-14(6-8-21)17-20-19-16(23)11-24-17/h1-5,7,14-15,22H,6,8,10-11H2,(H,19,23)