4-[(E)-C-methyl-N-[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-pyridin-3-ylimino-1,3-thiazol-3-yl]carbonimidoyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-C-methyl-N-[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-pyridin-3-ylimino-1,3-thiazol-3-yl]carbonimidoyl]benzenecarbonitrile Openeye Name: 4-[(E)-C-methyl-N-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-(3-pyridylimino)thiazol-3-yl]carbonimidoyl]benzonitrile CAS Name: 4-[(1E)-1-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-(3-pyridinylimino)-3-thiazolyl]imino]ethyl]benzonitrile IUPAC Name: 4-[(E)-C-methyl-N-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-pyridin-3-ylimino-1,3-thiazol-3-yl]carbonimidoyl]benzonitrile Traditional Name: 4-[(E)-N-[4-(3-keto-4H-1,4-benzoxazin-6-yl)-2-(3-pyridylimino)-4-thiazolin-3-yl]-C-methyl-carbonimidoyl]benzonitrile Formula: C25H18N6O2S MolecularWeight: 466.51442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1C(=CSC1=NC2=CN=CC=C2)C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C/C(=N\N1C(=CSC1=NC2=CN=CC=C2)C3=CC4=C(C=C3)OCC(=O)N4)/C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H18N6O2S/c1-16(18-6-4-17(12-26)5-7-18)30-31-22(15-34-25(31)28-20-3-2-10-27-13-20)19-8-9-23-21(11-19)29-24(32)14-33-23/h2-11,13,15H,14H2,1H3,(H,29,32)/b28-25?,30-16+