N-phenyl-1-(phenylmethyl)-3-propan-2-yl-imidazol-1-ium-2-carboximidothioate

Systemtic Name: N-phenyl-1-(phenylmethyl)-3-propan-2-yl-imidazol-1-ium-2-carboximidothioate Openeye Name: 1-benzyl-3-isopropyl-N-phenyl-imidazol-1-ium-2-carboximidothioate CAS Name: N-phenyl-1-(phenylmethyl)-3-propan-2-yl-2-imidazol-1-iumcarboximidothioate IUPAC Name: 1-benzyl-N-phenyl-3-propan-2-ylimidazol-1-ium-2-carboximidothioate Traditional Name: 1-benzyl-3-isopropyl-N-phenyl-imidazol-1-ium-2-carboximidothioate Formula: C20H21N3S MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C[N+](=C1C(=NC2=CC=CC=C2)[S-])CC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C=C[N+](=C1C(=NC2=CC=CC=C2)[S-])CC3=CC=CC=C3

InChI

InChI=1S/C20H21N3S/c1-16(2)23-14-13-22(15-17-9-5-3-6-10-17)20(23)19(24)21-18-11-7-4-8-12-18/h3-14,16H,15H2,1-2H3