3-oxidanylidene-2-[(3R,4R)-4-phenyl-3-thiophen-2-yl-3,4-dihydropyridazin-6-yl]inden-1-olate

Systemtic Name: 3-oxidanylidene-2-[(3R,4R)-4-phenyl-3-thiophen-2-yl-3,4-dihydropyridazin-6-yl]inden-1-olate Openeye Name: 3-oxo-2-[(3R,4R)-4-phenyl-3-(2-thienyl)-3,4-dihydropyridazin-6-yl]inden-1-olate CAS Name: 3-oxo-2-[(3R,4R)-4-phenyl-3-thiophen-2-yl-3,4-dihydropyridazin-6-yl]-1-indenolate IUPAC Name: 3-oxo-2-[(3R,4R)-4-phenyl-3-thiophen-2-yl-3,4-dihydropyridazin-6-yl]inden-1-olate Traditional Name: 3-keto-2-[(3R,4R)-4-phenyl-3-(2-thienyl)-3,4-dihydropyridazin-6-yl]inden-1-olate Formula: C23H15N2O2S- MolecularWeight: 383.4424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=C(N=NC2C3=CC=CS3)C4=C(C5=CC=CC=C5C4=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2C=C(N=N[C@H]2C3=CC=CS3)C4=C(C5=CC=CC=C5C4=O)[O-]

InChI

InChI=1S/C23H16N2O2S/c26-22-15-9-4-5-10-16(15)23(27)20(22)18-13-17(14-7-2-1-3-8-14)21(25-24-18)19-11-6-12-28-19/h1-13,17,21,26H/p-1/t17-,21-/m1/s1