1-ethyl-4-[(4-methylphenyl)carbamothioylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-4-[(4-methylphenyl)carbamothioylamino]pyrazole-3-carboxamide Openeye Name: 1-ethyl-4-(p-tolylcarbamothioylamino)pyrazole-3-carboxamide CAS Name: 1-ethyl-4-[[(4-methylanilino)-sulfanylidenemethyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-4-[(4-methylphenyl)carbamothioylamino]pyrazole-3-carboxamide Traditional Name: 1-ethyl-4-(p-tolylthiocarbamoylamino)pyrazole-3-carboxamide Formula: C14H17N5OS MolecularWeight: 303.38268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5OS/c1-3-19-8-11(12(18-19)13(15)20)17-14(21)16-10-6-4-9(2)5-7-10/h4-8H,3H2,1-2H3,(H2,15,20)(H2,16,17,21)