5-isothiocyanato-2,4-dimethoxy-N-methyl-benzenecarbothioamide

Systemtic Name: 5-isothiocyanato-2,4-dimethoxy-N-methyl-benzenecarbothioamide Openeye Name: 5-isothiocyanato-2,4-dimethoxy-N-methyl-benzenecarbothioamide CAS Name: 5-isothiocyanato-2,4-dimethoxy-N-methylbenzenecarbothioamide IUPAC Name: 5-isothiocyanato-2,4-dimethoxy-N-methylbenzenecarbothioamide Traditional Name: 5-isothiocyanato-2,4-dimethoxy-N-methyl-thiobenzamide Formula: C11H12N2O2S2 MolecularWeight: 268.35518

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1=CC(=C(C=C1OC)OC)N=C=S

Isomeric SMILES

CNC(=S)C1=CC(=C(C=C1OC)OC)N=C=S

InChI

InChI=1S/C11H12N2O2S2/c1-12-11(17)7-4-8(13-6-16)10(15-3)5-9(7)14-2/h4-5H,1-3H3,(H,12,17)