[(3S)-5-(4-bromophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]-(furan-2-yl)methanone

Systemtic Name: [(3S)-5-(4-bromophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]-(furan-2-yl)methanone Openeye Name: [(3S)-5-(4-bromophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]-(2-furyl)methanone CAS Name: [(3S)-5-(4-bromophenyl)-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]-(2-furanyl)methanone IUPAC Name: [(3S)-5-(4-bromophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]-(furan-2-yl)methanone Traditional Name: [(5S)-3-(4-bromophenyl)-5-quinoxalin-6-yl-2-pyrazolin-1-yl]-(2-furyl)methanone Formula: C22H15BrN4O2 MolecularWeight: 447.2841

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Br)C(=O)C3=CC=CO3)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

C1[C@H](N(N=C1C2=CC=C(C=C2)Br)C(=O)C3=CC=CO3)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C22H15BrN4O2/c23-16-6-3-14(4-7-16)18-13-20(27(26-18)22(28)21-2-1-11-29-21)15-5-8-17-19(12-15)25-10-9-24-17/h1-12,20H,13H2/t20-/m0/s1