2-(3-bromanylphenoxy)ethyl N'-(2,6-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl N'-(2,6-dimethylphenyl)carbamimidothioate Openeye Name: 2-[2-(3-bromophenoxy)ethyl]-3-(2,6-dimethylphenyl)isothiourea CAS Name: N'-(2,6-dimethylphenyl)carbamimidothioic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl N'-(2,6-dimethylphenyl)carbamimidothioate Traditional Name: 2-[2-(3-bromophenoxy)ethyl]-3-(2,6-dimethylphenyl)isothiourea Formula: C17H19BrN2OS MolecularWeight: 379.31456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N=C(N)SCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)N=C(N)SCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H19BrN2OS/c1-12-5-3-6-13(2)16(12)20-17(19)22-10-9-21-15-8-4-7-14(18)11-15/h3-8,11H,9-10H2,1-2H3,(H2,19,20)