2-(3,4-dimethylphenyl)sulfanyl-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-(1H-pyrazol-4-yl)-3-pyridinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-(1H-pyrazol-4-yl)nicotinamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CNN=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CNN=C3)C

InChI

InChI=1S/C17H16N4OS/c1-11-5-6-14(8-12(11)2)23-17-15(4-3-7-18-17)16(22)21-13-9-19-20-10-13/h3-10H,1-2H3,(H,19,20)(H,21,22)