4-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-(4-propan-2-ylphenyl)imino-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-(4-propan-2-ylphenyl)imino-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[[2-(4-isopropylphenyl)imino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)thiazol-3-yl]iminomethyl]benzonitrile CAS Name: 4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-(4-propan-2-ylphenyl)imino-3-thiazolyl]iminomethyl]benzonitrile IUPAC Name: 4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-(4-propan-2-ylphenyl)imino-1,3-thiazol-3-yl]iminomethyl]benzonitrile Traditional Name: 4-[[4-(3-keto-4H-1,4-benzoxazin-6-yl)-2-p-cumenylimino-4-thiazolin-3-yl]iminomethyl]benzonitrile Formula: C28H23N5O2S MolecularWeight: 493.57952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)N=CC5=CC=C(C=C5)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)N=CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C28H23N5O2S/c1-18(2)21-7-10-23(11-8-21)31-28-33(30-15-20-5-3-19(14-29)4-6-20)25(17-36-28)22-9-12-26-24(13-22)32-27(34)16-35-26/h3-13,15,17-18H,16H2,1-2H3,(H,32,34)