5-isothiocyanato-2-methoxy-N,N,3-trimethyl-benzenecarbothioamide

Systemtic Name: 5-isothiocyanato-2-methoxy-N,N,3-trimethyl-benzenecarbothioamide Openeye Name: 5-isothiocyanato-2-methoxy-N,N,3-trimethyl-benzenecarbothioamide CAS Name: 5-isothiocyanato-2-methoxy-N,N,3-trimethylbenzenecarbothioamide IUPAC Name: 5-isothiocyanato-2-methoxy-N,N,3-trimethylbenzenecarbothioamide Traditional Name: 5-isothiocyanato-2-methoxy-N,N,3-trimethyl-thiobenzamide Formula: C12H14N2OS2 MolecularWeight: 266.38236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)N=C=S)C(=S)N(C)C)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)N=C=S)C(=S)N(C)C)OC

InChI

InChI=1S/C12H14N2OS2/c1-8-5-9(13-7-16)6-10(11(8)15-4)12(17)14(2)3/h5-6H,1-4H3