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

Systemtic Name: 1-[5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]butan-1-one Openeye Name: 1-[5-(4-chlorophenyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]butan-1-one CAS Name: 1-[5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1-butanone IUPAC Name: 1-[5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]butan-1-one Traditional Name: 1-[3-(4-chlorophenyl)-5-(2-thienyl)-2-pyrazolin-1-yl]butan-1-one Formula: C17H17ClN2OS MolecularWeight: 332.84768

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CCCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C17H17ClN2OS/c1-2-4-17(21)20-15(16-5-3-10-22-16)11-14(19-20)12-6-8-13(18)9-7-12/h3,5-10,15H,2,4,11H2,1H3