methyl 2-(dimethylaminocarbamothioylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(dimethylaminocarbamothioylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(dimethylaminocarbamothioylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(2,2-dimethylhydrazinyl)-sulfanylidenemethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(dimethylaminocarbamothioylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(dimethylaminothiocarbamoylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C12H14N4O2S2 MolecularWeight: 310.39516

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC(=S)NC1=NC2=C(S1)C=C(C=C2)C(=O)OC

Isomeric SMILES

CN(C)NC(=S)NC1=NC2=C(S1)C=C(C=C2)C(=O)OC

InChI

InChI=1S/C12H14N4O2S2/c1-16(2)15-11(19)14-12-13-8-5-4-7(10(17)18-3)6-9(8)20-12/h4-6H,1-3H3,(H2,13,14,15,19)