2-ethyl-4-(phenylcarbamothioylamino)pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-4-(phenylcarbamothioylamino)pyrazole-3-carboxamide Openeye Name: 2-ethyl-4-(phenylcarbamothioylamino)pyrazole-3-carboxamide CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-4-(phenylcarbamothioylamino)pyrazole-3-carboxamide Traditional Name: 2-ethyl-4-(phenylthiocarbamoylamino)pyrazole-3-carboxamide Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N5OS/c1-2-18-11(12(14)19)10(8-15-18)17-13(20)16-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H2,14,19)(H2,16,17,20)