1-(2,4-dimethylphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea

Systemtic Name: 1-(2,4-dimethylphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea Openeye Name: 1-(2,4-dimethylphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea CAS Name: 1-(2,4-dimethylphenyl)-3-(3-pyridin-1-iumylmethyl)thiourea IUPAC Name: 1-(2,4-dimethylphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea Traditional Name: 1-(2,4-dimethylphenyl)-3-(pyridin-1-ium-3-ylmethyl)thiourea Formula: C15H18N3S+ MolecularWeight: 272.38852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NCC2=C[NH+]=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NCC2=C[NH+]=CC=C2)C

InChI

InChI=1S/C15H17N3S/c1-11-5-6-14(12(2)8-11)18-15(19)17-10-13-4-3-7-16-9-13/h3-9H,10H2,1-2H3,(H2,17,18,19)/p+1