N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=CNC3=S

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=CNC3=S

InChI

InChI=1S/C18H18N4OS/c1-12-16(11-20-17(23)15-9-6-10-19-18(15)24)13(2)22(21-12)14-7-4-3-5-8-14/h3-10H,11H2,1-2H3,(H,19,24)(H,20,23)