3-azanyl-1-(2-methylpropanoyl)-N-phenyl-pyrazole-4-carbothioamide

Systemtic Name: 3-azanyl-1-(2-methylpropanoyl)-N-phenyl-pyrazole-4-carbothioamide Openeye Name: 3-amino-1-(2-methylpropanoyl)-N-phenyl-pyrazole-4-carbothioamide CAS Name: 3-amino-1-(2-methyl-1-oxopropyl)-N-phenyl-4-pyrazolecarbothioamide IUPAC Name: 3-amino-1-(2-methylpropanoyl)-N-phenylpyrazole-4-carbothioamide Traditional Name: 3-amino-1-isobutyryl-N-phenyl-pyrazole-4-carbothioamide Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C=C(C(=N1)N)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)N1C=C(C(=N1)N)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C14H16N4OS/c1-9(2)14(19)18-8-11(12(15)17-18)13(20)16-10-6-4-3-5-7-10/h3-9H,1-2H3,(H2,15,17)(H,16,20)