2-[[4-[2-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-1,3-thiazin-6-yl]-2-methoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[2-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-1,3-thiazin-6-yl]-2-methoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[2-(3,5-dimethylanilino)-4-oxo-1,3-thiazin-6-yl]-2-methoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[2-(3,5-dimethylanilino)-4-oxo-1,3-thiazin-6-yl]-2-methoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[2-(3,5-dimethylanilino)-4-oxo-1,3-thiazin-6-yl]-2-methoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[2-(3,5-dimethylanilino)-4-keto-1,3-thiazin-6-yl]-2-methoxy-phenoxy]methyl]benzonitrile Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC(=O)C=C(S2)C3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC(=O)C=C(S2)C3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)OC)C

InChI

InChI=1S/C27H23N3O3S/c1-17-10-18(2)12-22(11-17)29-27-30-26(31)14-25(34-27)19-8-9-23(24(13-19)32-3)33-16-21-7-5-4-6-20(21)15-28/h4-14H,16H2,1-3H3,(H,29,30,31)