1-[3-(3-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[3-(3-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[3-(3-nitrophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[3-(3-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[3-(3-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[5-(3-nitrophenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]propan-1-one Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O3S/c1-2-16(20)18-14(10-13(17-18)15-7-4-8-23-15)11-5-3-6-12(9-11)19(21)22/h3-9,14H,2,10H2,1H3