5-chloranyl-1-methyl-3-phenyl-4-(phenylsulfanylmethyl)pyrazole

Systemtic Name: 5-chloranyl-1-methyl-3-phenyl-4-(phenylsulfanylmethyl)pyrazole Openeye Name: 5-chloro-1-methyl-3-phenyl-4-(phenylsulfanylmethyl)pyrazole CAS Name: 5-chloro-1-methyl-3-phenyl-4-[(phenylthio)methyl]pyrazole IUPAC Name: 5-chloro-1-methyl-3-phenyl-4-(phenylsulfanylmethyl)pyrazole Traditional Name: 5-chloro-1-methyl-3-phenyl-4-[(phenylthio)methyl]pyrazole Formula: C17H15ClN2S MolecularWeight: 314.8324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)CSC3=CC=CC=C3)Cl

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)CSC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H15ClN2S/c1-20-17(18)15(12-21-14-10-6-3-7-11-14)16(19-20)13-8-4-2-5-9-13/h2-11H,12H2,1H3