2-[(5-chloranyl-1-methyl-3-phenyl-pyrazol-4-yl)methylsulfanyl]-N-naphthalen-2-yl-benzamide

Systemtic Name: 2-[(5-chloranyl-1-methyl-3-phenyl-pyrazol-4-yl)methylsulfanyl]-N-naphthalen-2-yl-benzamide Openeye Name: 2-[(5-chloro-1-methyl-3-phenyl-pyrazol-4-yl)methylsulfanyl]-N-(2-naphthyl)benzamide CAS Name: 2-[(5-chloro-1-methyl-3-phenyl-4-pyrazolyl)methylthio]-N-(2-naphthalenyl)benzamide IUPAC Name: 2-[(5-chloro-1-methyl-3-phenylpyrazol-4-yl)methylsulfanyl]-N-naphthalen-2-ylbenzamide Traditional Name: 2-[(5-chloro-1-methyl-3-phenyl-pyrazol-4-yl)methylthio]-N-(2-naphthyl)benzamide Formula: C28H22ClN3OS MolecularWeight: 484.01178

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)CSC3=CC=CC=C3C(=O)NC4=CC5=CC=CC=C5C=C4)Cl

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)CSC3=CC=CC=C3C(=O)NC4=CC5=CC=CC=C5C=C4)Cl

InChI

InChI=1S/C28H22ClN3OS/c1-32-27(29)24(26(31-32)20-10-3-2-4-11-20)18-34-25-14-8-7-13-23(25)28(33)30-22-16-15-19-9-5-6-12-21(19)17-22/h2-17H,18H2,1H3,(H,30,33)