N-[[2-(carboxylatocarbamothioylamino)-3,4-dimethyl-phenyl]carbamothioyl]carbamate

Systemtic Name: N-[[2-(carboxylatocarbamothioylamino)-3,4-dimethyl-phenyl]carbamothioyl]carbamate Openeye Name: N-[[2-(carboxylatocarbamothioylamino)-3,4-dimethyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[(carboxylatoamino)-sulfanylidenemethyl]amino]-3,4-dimethylanilino]-sulfanylidenemethyl]carbamate IUPAC Name: N-[[2-(carboxylatocarbamothioylamino)-3,4-dimethylphenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(carboxylatothiocarbamoylamino)-3,4-dimethyl-phenyl]thiocarbamoyl]carbamate Formula: C12H12N4O4S2-2 MolecularWeight: 340.37808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)NC(=S)NC(=O)[O-])NC(=S)NC(=O)[O-])C

Isomeric SMILES

CC1=C(C(=C(C=C1)NC(=S)NC(=O)[O-])NC(=S)NC(=O)[O-])C

InChI

InChI=1S/C12H14N4O4S2/c1-5-3-4-7(13-9(21)15-11(17)18)8(6(5)2)14-10(22)16-12(19)20/h3-4H,1-2H3,(H,17,18)(H,19,20)(H2,13,15,21)(H2,14,16,22)/p-2