2-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-phenyl-imidazo[1,5-a]pyridin-4-ium-1-carbothioamide

Systemtic Name: 2-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-phenyl-imidazo[1,5-a]pyridin-4-ium-1-carbothioamide Openeye Name: 2-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-phenyl-imidazo[1,5-a]pyridin-4-ium-1-carbothioamide CAS Name: 2-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-phenyl-1-imidazo[1,5-a]pyridin-4-iumcarbothioamide IUPAC Name: 2-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-phenylimidazo[1,5-a]pyridin-4-ium-1-carbothioamide Traditional Name: 2-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-phenyl-imidazo[1,5-a]pyridin-4-ium-1-carbothioamide Formula: C27H21ClN3OS+ MolecularWeight: 470.99314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)C2=C3C=CC=C[N+]3=C(N2C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)C2=C3C=CC=C[N+]3=C(N2C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C27H20ClN3OS/c1-32-23-16-12-21(13-17-23)29-26(33)25-24-9-5-6-18-30(24)27(19-7-3-2-4-8-19)31(25)22-14-10-20(28)11-15-22/h2-18H,1H3/p+1