[2-(carboxycarbamothioylamino)-3,4-diethyl-phenyl]carbamothioylcarbamic acid

Systemtic Name: [2-(carboxycarbamothioylamino)-3,4-diethyl-phenyl]carbamothioylcarbamic acid Openeye Name: [2-(carboxycarbamothioylamino)-3,4-diethyl-phenyl]carbamothioylcarbamic acid CAS Name: [[2-[[(carboxyamino)-sulfanylidenemethyl]amino]-3,4-diethylanilino]-sulfanylidenemethyl]carbamic acid IUPAC Name: [2-(carboxycarbamothioylamino)-3,4-diethylphenyl]carbamothioylcarbamic acid Traditional Name: [2-(carboxythiocarbamoylamino)-3,4-diethyl-phenyl]thiocarbamoylcarbamic acid Formula: C14H18N4O4S2 MolecularWeight: 370.44712

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)NC(=S)NC(=O)O)NC(=S)NC(=O)O)CC

Isomeric SMILES

CCC1=C(C(=C(C=C1)NC(=S)NC(=O)O)NC(=S)NC(=O)O)CC

InChI

InChI=1S/C14H18N4O4S2/c1-3-7-5-6-9(15-11(23)17-13(19)20)10(8(7)4-2)16-12(24)18-14(21)22/h5-6H,3-4H2,1-2H3,(H,19,20)(H,21,22)(H2,15,17,23)(H2,16,18,24)