1-(4-methoxyphenyl)-3-(pyridin-1-ium-2-ylmethyl)thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-(pyridin-1-ium-2-ylmethyl)thiourea Openeye Name: 1-(4-methoxyphenyl)-3-(pyridin-1-ium-2-ylmethyl)thiourea CAS Name: 1-(4-methoxyphenyl)-3-(2-pyridin-1-iumylmethyl)thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-(pyridin-1-ium-2-ylmethyl)thiourea Traditional Name: 1-(4-methoxyphenyl)-3-(pyridin-1-ium-2-ylmethyl)thiourea Formula: C14H16N3OS+ MolecularWeight: 274.36134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=[NH+]2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=[NH+]2

InChI

InChI=1S/C14H15N3OS/c1-18-13-7-5-11(6-8-13)17-14(19)16-10-12-4-2-3-9-15-12/h2-9H,10H2,1H3,(H2,16,17,19)/p+1