2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]sulfanylmethyl]cyclopentan-1-one

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]sulfanylmethyl]cyclopentan-1-one Openeye Name: 2-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]sulfanylmethyl]cyclopentanone CAS Name: 2-[[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]thio]methyl]-1-cyclopentanone IUPAC Name: 2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]sulfanylmethyl]cyclopentan-1-one Traditional Name: 2-[[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]thio]methyl]cyclopentanone Formula: C20H18ClN3OS MolecularWeight: 383.89442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1)CSC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(C(=O)C1)CSC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN3OS/c21-16-6-4-14(5-7-16)19-18(13-8-10-22-11-9-13)20(24-23-19)26-12-15-2-1-3-17(15)25/h4-11,15H,1-3,12H2,(H,23,24)