N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[(2-nitrobenzoyl)amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[(2-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[(2-nitrobenzoyl)amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[(2-nitrobenzoyl)amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4S/c20-13(10-6-2-1-3-7-10)16-15(24)18-17-14(21)11-8-4-5-9-12(11)19(22)23/h4-5,8-10H,1-3,6-7H2,(H,17,21)(H2,16,18,20,24)