3-cyano-4-(2-methylpropoxy)benzenecarbothioamide

Systemtic Name: 3-cyano-4-(2-methylpropoxy)benzenecarbothioamide Openeye Name: 3-cyano-4-isobutoxy-benzenecarbothioamide CAS Name: 3-cyano-4-(2-methylpropoxy)benzenecarbothioamide IUPAC Name: 3-cyano-4-(2-methylpropoxy)benzenecarbothioamide Traditional Name: 3-cyano-4-isobutoxy-thiobenzamide Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=S)N)C#N

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=S)N)C#N

InChI

InChI=1S/C12H14N2OS/c1-8(2)7-15-11-4-3-9(12(14)16)5-10(11)6-13/h3-5,8H,7H2,1-2H3,(H2,14,16)