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

Systemtic Name: 4-[N-[2-cyclohexylimino-4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-3-yl]-C-methyl-carbonimidoyl]benzenecarbonitrile Openeye Name: 4-[N-[2-cyclohexylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)thiazol-3-yl]-C-methyl-carbonimidoyl]benzonitrile CAS Name: 4-[1-[[2-cyclohexylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-3-thiazolyl]imino]ethyl]benzonitrile IUPAC Name: 4-[N-[2-cyclohexylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-3-yl]-C-methylcarbonimidoyl]benzonitrile Traditional Name: 4-[N-[2-cyclohexylimino-4-(3-keto-4H-1,4-benzoxazin-6-yl)-4-thiazolin-3-yl]-C-methyl-carbonimidoyl]benzonitrile Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1C(=CSC1=NC2CCCCC2)C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CC(=NN1C(=CSC1=NC2CCCCC2)C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H25N5O2S/c1-17(19-9-7-18(14-27)8-10-19)30-31-23(16-34-26(31)28-21-5-3-2-4-6-21)20-11-12-24-22(13-20)29-25(32)15-33-24/h7-13,16,21H,2-6,15H2,1H3,(H,29,32)