2-[(6S)-2-[(4-dimethylaminophenyl)methylideneazaniumyl]-5-oxidanylidene-4H-1,3,4-thiadiazin-6-yl]ethanoate

Systemtic Name: 2-[(6S)-2-[(4-dimethylaminophenyl)methylideneazaniumyl]-5-oxidanylidene-4H-1,3,4-thiadiazin-6-yl]ethanoate Openeye Name: 2-[(6S)-2-[(4-dimethylaminophenyl)methyleneammonio]-5-oxo-4H-1,3,4-thiadiazin-6-yl]acetate CAS Name: 2-[(6S)-2-[(4-dimethylaminophenyl)methylideneammonio]-5-oxo-4H-1,3,4-thiadiazin-6-yl]acetate IUPAC Name: 2-[(6S)-2-[(4-dimethylaminophenyl)methylideneazaniumyl]-5-oxo-4H-1,3,4-thiadiazin-6-yl]acetate Traditional Name: 2-[(6S)-2-[4-(dimethylamino)benzylidene]ammonio-5-keto-4H-1,3,4-thiadiazin-6-yl]acetate Formula: C14H16N4O3S MolecularWeight: 320.36684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=[NH+]C2=NNC(=O)C(S2)CC(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C=[NH+]C2=NNC(=O)[C@@H](S2)CC(=O)[O-]

InChI

InChI=1S/C14H16N4O3S/c1-18(2)10-5-3-9(4-6-10)8-15-14-17-16-13(21)11(22-14)7-12(19)20/h3-6,8,11H,7H2,1-2H3,(H,16,21)(H,19,20)/t11-/m0/s1