1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]pentan-1-one

Systemtic Name: 1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]pentan-1-one Openeye Name: 1-[3-(4-chlorophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]pentan-1-one CAS Name: 1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1-pentanone IUPAC Name: 1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]pentan-1-one Traditional Name: 1-[5-(4-chlorophenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]pentan-1-one Formula: C18H19ClN2OS MolecularWeight: 346.87426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN2OS/c1-2-3-6-18(22)21-16(13-7-9-14(19)10-8-13)12-15(20-21)17-5-4-11-23-17/h4-5,7-11,16H,2-3,6,12H2,1H3