4-[(3,5-dimethylphenyl)carbamothioylamino]-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-[(3,5-dimethylphenyl)carbamothioylamino]-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-[(3,5-dimethylphenyl)carbamothioylamino]-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[(3,5-dimethylanilino)-sulfanylidenemethyl]amino]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-[(3,5-dimethylphenyl)carbamothioylamino]-1-ethylpyrazole-3-carboxamide Traditional Name: 4-[(3,5-dimethylphenyl)thiocarbamoylamino]-1-ethyl-pyrazole-3-carboxamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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