5-isothiocyanato-2-methoxy-3-methyl-N-morpholin-4-yl-benzenecarbothioamide

Systemtic Name: 5-isothiocyanato-2-methoxy-3-methyl-N-morpholin-4-yl-benzenecarbothioamide Openeye Name: 5-isothiocyanato-2-methoxy-3-methyl-N-morpholino-benzenecarbothioamide CAS Name: 5-isothiocyanato-2-methoxy-3-methyl-N-(4-morpholinyl)benzenecarbothioamide IUPAC Name: 5-isothiocyanato-2-methoxy-3-methyl-N-morpholin-4-ylbenzenecarbothioamide Traditional Name: 5-isothiocyanato-2-methoxy-3-methyl-N-morpholino-thiobenzamide Formula: C14H17N3O2S2 MolecularWeight: 323.43368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)N=C=S)C(=S)NN2CCOCC2)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)N=C=S)C(=S)NN2CCOCC2)OC

InChI

InChI=1S/C14H17N3O2S2/c1-10-7-11(15-9-20)8-12(13(10)18-2)14(21)16-17-3-5-19-6-4-17/h7-8H,3-6H2,1-2H3,(H,16,21)