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

Systemtic Name: 2-[4-(1-adamantyl)-3H-1,3-thiazol-2-ylidene]-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propanenitrile Openeye Name: 2-[4-(1-adamantyl)-3H-thiazol-2-ylidene]-3-(4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile CAS Name: 2-[4-(1-adamantyl)-3H-thiazol-2-ylidene]-3-(4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-[4-(1-adamantyl)-3H-1,3-thiazol-2-ylidene]-3-(4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 2-[4-(1-adamantyl)-4-thiazolin-2-ylidene]-3-(4-ketocyclohexa-2,5-dien-1-ylidene)propionitrile Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=C(C=C5C=CC(=O)C=C5)C#N)N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=C(C=C5C=CC(=O)C=C5)C#N)N4

InChI

InChI=1S/C22H22N2OS/c23-12-18(8-14-1-3-19(25)4-2-14)21-24-20(13-26-21)22-9-15-5-16(10-22)7-17(6-15)11-22/h1-4,8,13,15-17,24H,5-7,9-11H2