3-(6,6-dimethyl-2-oxidanylidene-3H-1,3,4-thiadiazin-5-yl)benzenecarbonitrile

Systemtic Name: 3-(6,6-dimethyl-2-oxidanylidene-3H-1,3,4-thiadiazin-5-yl)benzenecarbonitrile Openeye Name: 3-(6,6-dimethyl-2-oxo-3H-1,3,4-thiadiazin-5-yl)benzonitrile CAS Name: 3-(6,6-dimethyl-2-oxo-3H-1,3,4-thiadiazin-5-yl)benzonitrile IUPAC Name: 3-(6,6-dimethyl-2-oxo-3H-1,3,4-thiadiazin-5-yl)benzonitrile Traditional Name: 3-(2-keto-6,6-dimethyl-3H-1,3,4-thiadiazin-5-yl)benzonitrile Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NNC(=O)S1)C2=CC=CC(=C2)C#N)C

Isomeric SMILES

CC1(C(=NNC(=O)S1)C2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C12H11N3OS/c1-12(2)10(14-15-11(16)17-12)9-5-3-4-8(6-9)7-13/h3-6H,1-2H3,(H,15,16)