tert-butyl (2Z)-2-[3,3-dicyano-2-(4-methoxyphenyl)prop-2-enylidene]-1,3-thiazinane-3-carboxylate

Systemtic Name: tert-butyl (2Z)-2-[3,3-dicyano-2-(4-methoxyphenyl)prop-2-enylidene]-1,3-thiazinane-3-carboxylate Openeye Name: tert-butyl (2Z)-2-[3,3-dicyano-2-(4-methoxyphenyl)prop-2-enylidene]-1,3-thiazinane-3-carboxylate CAS Name: (2Z)-2-[3,3-dicyano-2-(4-methoxyphenyl)prop-2-enylidene]-1,3-thiazinane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2Z)-2-[3,3-dicyano-2-(4-methoxyphenyl)prop-2-enylidene]-1,3-thiazinane-3-carboxylate Traditional Name: (2Z)-2-[3,3-dicyano-2-(4-methoxyphenyl)prop-2-enylidene]-1,3-thiazinane-3-carboxylic acid tert-butyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCSC1=CC(=C(C#N)C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N\1CCCS/C1=C\C(=C(C#N)C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H23N3O3S/c1-21(2,3)27-20(25)24-10-5-11-28-19(24)12-18(16(13-22)14-23)15-6-8-17(26-4)9-7-15/h6-9,12H,5,10-11H2,1-4H3/b19-12-