2-[4-(1-adamantyl)-3H-1,3-thiazol-2-ylidene]-3-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile

Systemtic Name: 2-[4-(1-adamantyl)-3H-1,3-thiazol-2-ylidene]-3-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile Openeye Name: 2-[4-(1-adamantyl)-3H-thiazol-2-ylidene]-3-(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)propanenitrile CAS Name: 2-[4-(1-adamantyl)-3H-thiazol-2-ylidene]-3-(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-[4-(1-adamantyl)-3H-1,3-thiazol-2-ylidene]-3-(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 2-[4-(1-adamantyl)-4-thiazolin-2-ylidene]-3-(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)propionitrile Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC(=CS2)C34CC5CC(C3)CC(C5)C4)C#N)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=CC(=C2NC(=CS2)C34CC5CC(C3)CC(C5)C4)C#N)C=C(C1=O)OC

InChI

InChI=1S/C24H26N2O3S/c1-28-19-7-14(8-20(29-2)22(19)27)6-18(12-25)23-26-21(13-30-23)24-9-15-3-16(10-24)5-17(4-15)11-24/h6-8,13,15-17,26H,3-5,9-11H2,1-2H3