(2-bromophenyl)methyl N'-(2,6-dimethylphenyl)carbamimidothioate

Systemtic Name: (2-bromophenyl)methyl N'-(2,6-dimethylphenyl)carbamimidothioate Openeye Name: 2-[(2-bromophenyl)methyl]-3-(2,6-dimethylphenyl)isothiourea CAS Name: N'-(2,6-dimethylphenyl)carbamimidothioic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl N'-(2,6-dimethylphenyl)carbamimidothioate Traditional Name: 2-(2-bromobenzyl)-3-(2,6-dimethylphenyl)isothiourea Formula: C16H17BrN2S MolecularWeight: 349.28858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N=C(N)SCC2=CC=CC=C2Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)N=C(N)SCC2=CC=CC=C2Br

InChI

InChI=1S/C16H17BrN2S/c1-11-6-5-7-12(2)15(11)19-16(18)20-10-13-8-3-4-9-14(13)17/h3-9H,10H2,1-2H3,(H2,18,19)