1-phenyl-3-(2-pyridin-1-ium-1-ylethanoylamino)thiourea chloride

Systemtic Name: 1-phenyl-3-(2-pyridin-1-ium-1-ylethanoylamino)thiourea chloride Openeye Name: 1-phenyl-3-[(2-pyridin-1-ium-1-ylacetyl)amino]thiourea chloride CAS Name: 1-[[1-oxo-2-(1-pyridin-1-iumyl)ethyl]amino]-3-phenylthiourea chloride IUPAC Name: 1-phenyl-3-[(2-pyridin-1-ium-1-ylacetyl)amino]thiourea chloride Traditional Name: 1-phenyl-3-[(2-pyridin-1-ium-1-ylacetyl)amino]thiourea chloride Formula: C14H15ClN4OS MolecularWeight: 322.8131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)C[N+]2=CC=CC=C2.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)C[N+]2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C14H14N4OS.ClH/c19-13(11-18-9-5-2-6-10-18)16-17-14(20)15-12-7-3-1-4-8-12;/h1-10H,11H2,(H2-,15,16,17,19,20);1H