4-[(2,4-dimethylphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-[(2,4-dimethylphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-[(2,4-dimethylphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[(2,4-dimethylanilino)-sulfanylidenemethyl]amino]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-[(2,4-dimethylphenyl)carbamothioylamino]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-[(2,4-dimethylphenyl)thiocarbamoylamino]-2-ethyl-pyrazole-3-carboxamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=S)NC2=C(C=C(C=C2)C)C)C(=O)N

Isomeric SMILES

CCN1C(=C(C=N1)NC(=S)NC2=C(C=C(C=C2)C)C)C(=O)N

InChI

InChI=1S/C15H19N5OS/c1-4-20-13(14(16)21)12(8-17-20)19-15(22)18-11-6-5-9(2)7-10(11)3/h5-8H,4H2,1-3H3,(H2,16,21)(H2,18,19,22)