1-methyl-2-(phenylmethyl)-3-sulfanylidene-imidazo[1,5-a]indol-2-ium-4-olate

Systemtic Name: 1-methyl-2-(phenylmethyl)-3-sulfanylidene-imidazo[1,5-a]indol-2-ium-4-olate Openeye Name: 2-benzyl-1-methyl-3-thioxo-imidazo[1,5-a]indol-2-ium-4-olate CAS Name: 1-methyl-2-(phenylmethyl)-3-sulfanylidene-4-imidazo[1,5-a]indol-2-iumolate IUPAC Name: 2-benzyl-1-methyl-3-sulfanylideneimidazo[1,5-a]indol-2-ium-4-olate Traditional Name: 2-benzyl-1-methyl-3-thioxo-imidaz[1,5-a]indol-2-ium-4-olate Formula: C18H14N2OS MolecularWeight: 306.38156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=S)C2=C(C3=CC=CC=C3N12)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=[N+](C(=S)C2=C(C3=CC=CC=C3N12)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C18H14N2OS/c1-12-19(11-13-7-3-2-4-8-13)18(22)16-17(21)14-9-5-6-10-15(14)20(12)16/h2-10H,11H2,1H3