3-[(3,4-dimethylphenoxy)methyl]benzenecarbothioamide

Systemtic Name: 3-[(3,4-dimethylphenoxy)methyl]benzenecarbothioamide Openeye Name: 3-[(3,4-dimethylphenoxy)methyl]benzenecarbothioamide CAS Name: 3-[(3,4-dimethylphenoxy)methyl]benzenecarbothioamide IUPAC Name: 3-[(3,4-dimethylphenoxy)methyl]benzenecarbothioamide Traditional Name: 3-[(3,4-dimethylphenoxy)methyl]thiobenzamide Formula: C16H17NOS MolecularWeight: 271.37728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC=CC(=C2)C(=S)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC=CC(=C2)C(=S)N)C

InChI

InChI=1S/C16H17NOS/c1-11-6-7-15(8-12(11)2)18-10-13-4-3-5-14(9-13)16(17)19/h3-9H,10H2,1-2H3,(H2,17,19)