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

Systemtic Name: 3-cyano-N-(3-methoxyphenyl)-4-(2-methylpropoxy)benzenecarbothioamide Openeye Name: 3-cyano-4-isobutoxy-N-(3-methoxyphenyl)benzenecarbothioamide CAS Name: 3-cyano-N-(3-methoxyphenyl)-4-(2-methylpropoxy)benzenecarbothioamide IUPAC Name: 3-cyano-N-(3-methoxyphenyl)-4-(2-methylpropoxy)benzenecarbothioamide Traditional Name: 3-cyano-4-isobutoxy-N-(3-methoxyphenyl)thiobenzamide Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=S)NC2=CC(=CC=C2)OC)C#N

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=S)NC2=CC(=CC=C2)OC)C#N

InChI

InChI=1S/C19H20N2O2S/c1-13(2)12-23-18-8-7-14(9-15(18)11-20)19(24)21-16-5-4-6-17(10-16)22-3/h4-10,13H,12H2,1-3H3,(H,21,24)