S-methyl (NE)-N-[dimethylamino-[methyl(phenylcarbamoyl)amino]methylidene]carbamothioate

Systemtic Name: S-methyl (NE)-N-[dimethylamino-[methyl(phenylcarbamoyl)amino]methylidene]carbamothioate Openeye Name: S-methyl (NE)-N-[dimethylamino-[methyl(phenylcarbamoyl)amino]methylene]carbamothioate CAS Name: (NE)-N-[[[anilino(oxo)methyl]-methylamino]-(dimethylamino)methylidene]carbamothioic acid S-methyl ester IUPAC Name: S-methyl (NE)-N-[dimethylamino-[methyl(phenylcarbamoyl)amino]methylidene]carbamothioate Traditional Name: (NE)-N-[dimethylamino-[methyl(phenylcarbamoyl)amino]methylene]thiocarbamic acid S-methyl ester Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=NC(=O)SC)N(C)C(=O)NC1=CC=CC=C1

Isomeric SMILES

CN(C)/C(=N\C(=O)SC)/N(C)C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C13H18N4O2S/c1-16(2)11(15-13(19)20-4)17(3)12(18)14-10-8-6-5-7-9-10/h5-9H,1-4H3,(H,14,18)/b15-11+