[(3R)-3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-yl-methanone

Systemtic Name: [(3R)-3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-yl-methanone Openeye Name: [(3R)-3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-(2-thienyl)methanone CAS Name: [(3R)-3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone IUPAC Name: [(3R)-3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone Traditional Name: [(5R)-5-(1,3-benzodioxol-5-yl)-3-phenyl-2-pyrazolin-1-yl]-(2-thienyl)methanone Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2)C(=O)C3=CC=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=CC=C2)C(=O)C3=CC=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H16N2O3S/c24-21(20-7-4-10-27-20)23-17(12-16(22-23)14-5-2-1-3-6-14)15-8-9-18-19(11-15)26-13-25-18/h1-11,17H,12-13H2/t17-/m1/s1