S-methyl (NE)-N-[[cyclohexen-1-ylcarbamoyl(methyl)amino]-(dimethylamino)methylidene]carbamothioate

Systemtic Name: S-methyl (NE)-N-[[cyclohexen-1-ylcarbamoyl(methyl)amino]-(dimethylamino)methylidene]carbamothioate Openeye Name: S-methyl (NE)-N-[[cyclohexen-1-ylcarbamoyl(methyl)amino]-(dimethylamino)methylene]carbamothioate CAS Name: (NE)-N-[[[(1-cyclohexenylamino)-oxomethyl]-methylamino]-(dimethylamino)methylidene]carbamothioic acid S-methyl ester IUPAC Name: S-methyl (NE)-N-[[cyclohexen-1-ylcarbamoyl(methyl)amino]-(dimethylamino)methylidene]carbamothioate Traditional Name: (NE)-N-[[cyclohexen-1-ylcarbamoyl(methyl)amino]-(dimethylamino)methylene]thiocarbamic acid S-methyl ester Formula: C13H22N4O2S MolecularWeight: 298.40438

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=NC(=O)SC)N(C)C(=O)NC1=CCCCC1

Isomeric SMILES

CN(C)/C(=N\C(=O)SC)/N(C)C(=O)NC1=CCCCC1

InChI

InChI=1S/C13H22N4O2S/c1-16(2)11(15-13(19)20-4)17(3)12(18)14-10-8-6-5-7-9-10/h8H,5-7,9H2,1-4H3,(H,14,18)/b15-11+