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(4E)-4-[4-(1-adamantyl)-5H-1,3-thiazol-3-ium-2-ylidene]-2,5,6-trimethyl-pyridazin-2-ium-3-one

(4E)-4-[4-(1-adamantyl)-5H-1,3-thiazol-3-ium-2-ylidene]-2,5,6-trimethyl-pyridazin-2-ium-3-one

Systemtic Name:(4E)-4-[4-(1-adamantyl)-5H-1,3-thiazol-3-ium-2-ylidene]-2,5,6-trimethyl-pyridazin-2-ium-3-one
Openeye Name:(4E)-4-[4-(1-adamantyl)-5H-thiazol-3-ium-2-ylidene]-2,5,6-trimethyl-pyridazin-2-ium-3-one
CAS Name:(4E)-4-[4-(1-adamantyl)-5H-thiazol-3-ium-2-ylidene]-2,5,6-trimethyl-3-pyridazin-2-iumone
IUPAC Name:(4E)-4-[4-(1-adamantyl)-5H-1,3-thiazol-3-ium-2-ylidene]-2,5,6-trimethylpyridazin-2-ium-3-one
Traditional Name:(4E)-4-[4-(1-adamantyl)-3-thiazolin-3-ium-2-ylidene]-2,5,6-trimethyl-pyridazin-2-ium-3-one
Formula: C20H27N3OS+2
MolecularWeight: 357.51288
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=[N+](C(=O)C1=C2[NH+]=C(CS2)C34CC5CC(C3)CC(C5)C4)C)C


Isomeric SMILES

CC\1=C(N=[N+](C(=O)/C1=C/2\[NH+]=C(CS2)C34CC5CC(C3)CC(C5)C4)C)C


InChI

InChI=1S/C20H26N3OS/c1-11-12(2)22-23(3)19(24)17(11)18-21-16(10-25-18)20-7-13-4-14(8-20)6-15(5-13)9-20/h13-15H,4-10H2,1-3H3/q+1/p+1


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