N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-(2,4-dichlorobenzyl)pyrazol-3-yl]-2-(phenylthio)nicotinamide Formula: C22H16Cl2N4OS MolecularWeight: 455.35964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H16Cl2N4OS/c23-16-9-8-15(19(24)13-16)14-28-20(10-12-26-28)27-21(29)18-7-4-11-25-22(18)30-17-5-2-1-3-6-17/h1-13H,14H2,(H,27,29)