3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-(1-pyridin-1-ium-2-ylethyl)thiourea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-(1-pyridin-1-ium-2-ylethyl)thiourea Openeye Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-(1-pyridin-1-ium-2-ylethyl)thiourea CAS Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[1-(2-pyridin-1-iumyl)ethyl]thiourea IUPAC Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-(1-pyridin-1-ium-2-ylethyl)thiourea Traditional Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-(1-pyridin-1-ium-2-ylethyl)thiourea Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)N(CCOC)C(C)C2=CC=CC=[NH+]2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N(CCOC)C(C)C2=CC=CC=[NH+]2

InChI

InChI=1S/C19H25N3OS/c1-14-8-7-9-15(2)18(14)21-19(24)22(12-13-23-4)16(3)17-10-5-6-11-20-17/h5-11,16H,12-13H2,1-4H3,(H,21,24)/p+1