[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methanone

Systemtic Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methanone Openeye Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methanone CAS Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methanone IUPAC Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methanone Traditional Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methanone Formula: C27H24N4O3 MolecularWeight: 452.50446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C27H24N4O3/c32-27(30-13-5-9-23(30)19-10-11-24-25(16-19)34-15-14-33-24)22-18-31(21-7-2-1-3-8-21)29-26(22)20-6-4-12-28-17-20/h1-4,6-8,10-12,16-18,23H,5,9,13-15H2/t23-/m0/s1