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

Systemtic Name: 4-[(3-ethanoylphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-[(3-acetylphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[(3-acetylanilino)-sulfanylidenemethyl]amino]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-[(3-acetylphenyl)carbamothioylamino]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-[(3-acetylphenyl)thiocarbamoylamino]-2-ethyl-pyrazole-3-carboxamide Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5O2S/c1-3-20-13(14(16)22)12(8-17-20)19-15(23)18-11-6-4-5-10(7-11)9(2)21/h4-8H,3H2,1-2H3,(H2,16,22)(H2,18,19,23)