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

Systemtic Name: 2-ethyl-4-(phenethylcarbamothioylamino)pyrazole-3-carboxamide Openeye Name: 2-ethyl-4-(phenethylcarbamothioylamino)pyrazole-3-carboxamide CAS Name: 2-ethyl-4-[[(phenethylamino)-sulfanylidenemethyl]amino]-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-4-(phenethylcarbamothioylamino)pyrazole-3-carboxamide Traditional Name: 2-ethyl-4-(phenethylthiocarbamoylamino)pyrazole-3-carboxamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=S)NCCC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CCN1C(=C(C=N1)NC(=S)NCCC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C15H19N5OS/c1-2-20-13(14(16)21)12(10-18-20)19-15(22)17-9-8-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3,(H2,16,21)(H2,17,19,22)