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

Systemtic Name: 1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]hexan-1-one Openeye Name: 1-[3-(4-chlorophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]hexan-1-one CAS Name: 1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1-hexanone IUPAC Name: 1-[3-(4-chlorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]hexan-1-one Traditional Name: 1-[5-(4-chlorophenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]hexan-1-one Formula: C19H21ClN2OS MolecularWeight: 360.90084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2OS/c1-2-3-4-7-19(23)22-17(14-8-10-15(20)11-9-14)13-16(21-22)18-6-5-12-24-18/h5-6,8-12,17H,2-4,7,13H2,1H3