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1,3-dibutyl-N-phenyl-imidazol-1-ium-2-carboximidothioate

1,3-dibutyl-N-phenyl-imidazol-1-ium-2-carboximidothioate

Systemtic Name:1,3-dibutyl-N-phenyl-imidazol-1-ium-2-carboximidothioate
Openeye Name:1,3-dibutyl-N-phenyl-imidazol-1-ium-2-carboximidothioate
CAS Name:1,3-dibutyl-N-phenyl-2-imidazol-1-iumcarboximidothioate
IUPAC Name:1,3-dibutyl-N-phenylimidazol-1-ium-2-carboximidothioate
Traditional Name:1,3-dibutyl-N-phenyl-imidazol-1-ium-2-carboximidothioate
Formula: C18H25N3S
MolecularWeight: 315.4762
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1C(=NC2=CC=CC=C2)[S-])CCCC


Isomeric SMILES

CCCCN1C=C[N+](=C1C(=NC2=CC=CC=C2)[S-])CCCC


InChI

InChI=1S/C18H25N3S/c1-3-5-12-20-14-15-21(13-6-4-2)18(20)17(22)19-16-10-8-7-9-11-16/h7-11,14-15H,3-6,12-13H2,1-2H3


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