5-bromanyl-2-[2-[(3S)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]benzaldehyde

Systemtic Name: 5-bromanyl-2-[2-[(3S)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]benzaldehyde Openeye Name: 5-bromo-2-[2-[(3S)-3-(2-furyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethoxy]benzaldehyde CAS Name: 5-bromo-2-[2-[(3S)-3-(2-furanyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]benzaldehyde IUPAC Name: 5-bromo-2-[2-[(3S)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]benzaldehyde Traditional Name: 5-bromo-2-[2-[(5S)-5-(2-furyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethoxy]benzaldehyde Formula: C20H15BrN2O4S MolecularWeight: 459.3131

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)COC3=C(C=C(C=C3)Br)C=O)C4=CC=CO4

Isomeric SMILES

C1[C@H](N(N=C1C2=CC=CS2)C(=O)COC3=C(C=C(C=C3)Br)C=O)C4=CC=CO4

InChI

InChI=1S/C20H15BrN2O4S/c21-14-5-6-17(13(9-14)11-24)27-12-20(25)23-16(18-3-1-7-26-18)10-15(22-23)19-4-2-8-28-19/h1-9,11,16H,10,12H2/t16-/m0/s1