4-(cyclohexylcarbamothioylamino)-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-(cyclohexylcarbamothioylamino)-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-(cyclohexylcarbamothioylamino)-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-(cyclohexylcarbamothioylamino)-1-ethylpyrazole-3-carboxamide Traditional Name: 4-(cyclohexylthiocarbamoylamino)-1-ethyl-pyrazole-3-carboxamide Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N)NC(=S)NC2CCCCC2

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N)NC(=S)NC2CCCCC2

InChI

InChI=1S/C13H21N5OS/c1-2-18-8-10(11(17-18)12(14)19)16-13(20)15-9-6-4-3-5-7-9/h8-9H,2-7H2,1H3,(H2,14,19)(H2,15,16,20)