2-[2-(3,5-dimethylphenoxy)ethoxy]naphthalene-1-carbothioamide

Systemtic Name: 2-[2-(3,5-dimethylphenoxy)ethoxy]naphthalene-1-carbothioamide Openeye Name: 2-[2-(3,5-dimethylphenoxy)ethoxy]naphthalene-1-carbothioamide CAS Name: 2-[2-(3,5-dimethylphenoxy)ethoxy]-1-naphthalenecarbothioamide IUPAC Name: 2-[2-(3,5-dimethylphenoxy)ethoxy]naphthalene-1-carbothioamide Traditional Name: 2-[2-(3,5-dimethylphenoxy)ethoxy]naphthalene-1-carbothioamide Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC2=C(C3=CC=CC=C3C=C2)C(=S)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC2=C(C3=CC=CC=C3C=C2)C(=S)N)C

InChI

InChI=1S/C21H21NO2S/c1-14-11-15(2)13-17(12-14)23-9-10-24-19-8-7-16-5-3-4-6-18(16)20(19)21(22)25/h3-8,11-13H,9-10H2,1-2H3,(H2,22,25)