(4-tert-butylphenyl) 2,3-dithiophen-2-ylquinoxaline-6-carboxylate

Systemtic Name: (4-tert-butylphenyl) 2,3-dithiophen-2-ylquinoxaline-6-carboxylate Openeye Name: (4-tert-butylphenyl) 2,3-bis(2-thienyl)quinoxaline-6-carboxylate CAS Name: 2,3-dithiophen-2-yl-6-quinoxalinecarboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 2,3-dithiophen-2-ylquinoxaline-6-carboxylate Traditional Name: 2,3-bis(2-thienyl)quinoxaline-6-carboxylic acid (4-tert-butylphenyl) ester Formula: C27H22N2O2S2 MolecularWeight: 470.60578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CS4)C5=CC=CS5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CS4)C5=CC=CS5

InChI

InChI=1S/C27H22N2O2S2/c1-27(2,3)18-9-11-19(12-10-18)31-26(30)17-8-13-20-21(16-17)29-25(23-7-5-15-33-23)24(28-20)22-6-4-14-32-22/h4-16H,1-3H3