2-(4-bromanylphenoxy)ethyl N'-(3,5-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl N'-(3,5-dimethylphenyl)carbamimidothioate Openeye Name: 2-[2-(4-bromophenoxy)ethyl]-3-(3,5-dimethylphenyl)isothiourea CAS Name: N'-(3,5-dimethylphenyl)carbamimidothioic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl N'-(3,5-dimethylphenyl)carbamimidothioate Traditional Name: 2-[2-(4-bromophenoxy)ethyl]-3-(3,5-dimethylphenyl)isothiourea Formula: C17H19BrN2OS MolecularWeight: 379.31456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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