1-[2-[(3R)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]quinoxalin-2-one

Systemtic Name: 1-[2-[(3R)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]quinoxalin-2-one Openeye Name: 1-[2-[(3R)-3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]quinoxalin-2-one CAS Name: 1-[2-[(3R)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-2-quinoxalinone IUPAC Name: 1-[2-[(3R)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]quinoxalin-2-one Traditional Name: 1-[2-[(5R)-5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]quinoxalin-2-one Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CN3C4=CC=CC=C4N=CC3=O)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CC(=NN2C(=O)CN3C4=CC=CC=C4N=CC3=O)C5=CC=CS5)OC

InChI

InChI=1S/C25H22N4O4S/c1-32-21-10-9-16(12-22(21)33-2)20-13-18(23-8-5-11-34-23)27-29(20)25(31)15-28-19-7-4-3-6-17(19)26-14-24(28)30/h3-12,14,20H,13,15H2,1-2H3/t20-/m1/s1