3-phenyl-1-pyridin-1-ium-1-yl-1-(1,1,2,2-tetracyanoethyl)thiourea

Systemtic Name: 3-phenyl-1-pyridin-1-ium-1-yl-1-(1,1,2,2-tetracyanoethyl)thiourea Openeye Name: 3-phenyl-1-pyridin-1-ium-1-yl-1-(1,1,2,2-tetracyanoethyl)thiourea CAS Name: 3-phenyl-1-(1-pyridin-1-iumyl)-1-(1,1,2,2-tetracyanoethyl)thiourea IUPAC Name: 3-phenyl-1-pyridin-1-ium-1-yl-1-(1,1,2,2-tetracyanoethyl)thiourea Traditional Name: 3-phenyl-1-pyridin-1-ium-1-yl-1-(1,1,2,2-tetracyanoethyl)thiourea Formula: C18H12N7S+ MolecularWeight: 358.39978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)N(C(C#N)(C#N)C(C#N)C#N)[N+]2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N(C(C#N)(C#N)C(C#N)C#N)[N+]2=CC=CC=C2

InChI

InChI=1S/C18H11N7S/c19-11-15(12-20)18(13-21,14-22)25(24-9-5-2-6-10-24)17(26)23-16-7-3-1-4-8-16/h1-10,15H/p+1