N-(3-azanyl-3-sulfanylidene-propyl)-1-methyl-N-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(3-azanyl-3-sulfanylidene-propyl)-1-methyl-N-phenyl-pyrazole-4-carboxamide Openeye Name: N-(3-amino-3-thioxo-propyl)-1-methyl-N-phenyl-pyrazole-4-carboxamide CAS Name: N-(3-amino-3-sulfanylidenepropyl)-1-methyl-N-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(3-amino-3-sulfanylidenepropyl)-1-methyl-N-phenylpyrazole-4-carboxamide Traditional Name: N-(3-amino-3-thioxo-propyl)-1-methyl-N-phenyl-pyrazole-4-carboxamide Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N(CCC(=S)N)C2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=N1)C(=O)N(CCC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C14H16N4OS/c1-17-10-11(9-16-17)14(19)18(8-7-13(15)20)12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3,(H2,15,20)