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

Systemtic Name: 4-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-propan-2-ylimino-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[[2-isopropylimino-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-propan-2-ylimino-3-thiazolyl]iminomethyl]benzonitrile IUPAC Name: 4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-propan-2-ylimino-1,3-thiazol-3-yl]iminomethyl]benzonitrile Traditional Name: 4-[[2-isopropylimino-4-(3-keto-4H-1,4-benzoxazin-6-yl)-4-thiazolin-3-yl]iminomethyl]benzonitrile Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)N=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H19N5O2S/c1-14(2)25-22-27(24-11-16-5-3-15(10-23)4-6-16)19(13-30-22)17-7-8-20-18(9-17)26-21(28)12-29-20/h3-9,11,13-14H,12H2,1-2H3,(H,26,28)