1-(3,5-dimethoxyphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea CAS Name: 1-(3,5-dimethoxyphenyl)-3-(3-pyridin-1-iumylmethyl)thiourea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea Traditional Name: 1-(3,5-dimethoxyphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea Formula: C15H18N3O2S+ MolecularWeight: 304.38732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NCC2=C[NH+]=CC=C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NCC2=C[NH+]=CC=C2)OC

InChI

InChI=1S/C15H17N3O2S/c1-19-13-6-12(7-14(8-13)20-2)18-15(21)17-10-11-4-3-5-16-9-11/h3-9H,10H2,1-2H3,(H2,17,18,21)/p+1