1-[(3S)-5-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-phenyl-pyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3S)-5-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-phenyl-pyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-5-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-phenyl-pyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-5-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-phenyl-4-pyrazolyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-5-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-phenylpyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-3-(1,3-benzodioxol-5-yl)-5-(3-methyl-1-phenyl-pyrazol-4-yl)-2-pyrazolin-1-yl]ethanone Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2CC(=NN2C(=O)C)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C=C1[C@@H]2CC(=NN2C(=O)C)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C22H20N4O3/c1-14-18(12-25(23-14)17-6-4-3-5-7-17)20-11-19(24-26(20)15(2)27)16-8-9-21-22(10-16)29-13-28-21/h3-10,12,20H,11,13H2,1-2H3/t20-/m0/s1