5-[(Z)-C-methyl-N-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]carbonimidoyl]thiophene-2-carboxylate

Systemtic Name: 5-[(Z)-C-methyl-N-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]carbonimidoyl]thiophene-2-carboxylate Openeye Name: 5-[(Z)-C-methyl-N-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]carbonimidoyl]thiophene-2-carboxylate CAS Name: 5-[(1Z)-1-[[[[(1S,2S)-2-methylcyclohexyl]amino]-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-thiophenecarboxylate IUPAC Name: 5-[(Z)-C-methyl-N-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]carbonimidoyl]thiophene-2-carboxylate Traditional Name: 5-[(Z)-C-methyl-N-[[(1S,2S)-2-methylcyclohexyl]thiocarbamoylamino]carbonimidoyl]-2-thenoate Formula: C15H20N3O2S2- MolecularWeight: 338.4682

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NN=C(C)C2=CC=C(S2)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)N/N=C(/C)\C2=CC=C(S2)C(=O)[O-]

InChI

InChI=1S/C15H21N3O2S2/c1-9-5-3-4-6-11(9)16-15(21)18-17-10(2)12-7-8-13(22-12)14(19)20/h7-9,11H,3-6H2,1-2H3,(H,19,20)(H2,16,18,21)/p-1/b17-10-/t9-,11-/m0/s1