N,N-diethyl-5-isothiocyanato-2-methoxy-benzenecarbothioamide

Systemtic Name: N,N-diethyl-5-isothiocyanato-2-methoxy-benzenecarbothioamide Openeye Name: N,N-diethyl-5-isothiocyanato-2-methoxy-benzenecarbothioamide CAS Name: N,N-diethyl-5-isothiocyanato-2-methoxybenzenecarbothioamide IUPAC Name: N,N-diethyl-5-isothiocyanato-2-methoxybenzenecarbothioamide Traditional Name: N,N-diethyl-5-isothiocyanato-2-methoxy-thiobenzamide Formula: C13H16N2OS2 MolecularWeight: 280.40894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2OS2/c1-4-15(5-2)13(18)11-8-10(14-9-17)6-7-12(11)16-3/h6-8H,4-5H2,1-3H3