2-[2-[2-(2,5-dimethoxyphenyl)imino-1,3-thiazinan-3-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[2-(2,5-dimethoxyphenyl)imino-1,3-thiazinan-3-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[2-(2,5-dimethoxyphenyl)imino-1,3-thiazinan-3-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[2-(2,5-dimethoxyphenyl)imino-1,3-thiazinan-3-yl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[2-(2,5-dimethoxyphenyl)imino-1,3-thiazinan-3-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[2-(2,5-dimethoxyphenyl)imino-1,3-thiazinan-3-yl]-2-keto-ethoxy]benzonitrile Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N=C2N(CCCS2)C(=O)COC3=CC=CC=C3C#N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N=C2N(CCCS2)C(=O)COC3=CC=CC=C3C#N

InChI

InChI=1S/C21H21N3O4S/c1-26-16-8-9-19(27-2)17(12-16)23-21-24(10-5-11-29-21)20(25)14-28-18-7-4-3-6-15(18)13-22/h3-4,6-9,12H,5,10-11,14H2,1-2H3