ethyl 4-[(3-thiophen-2-ylquinoxalin-2-yl)amino]benzoate

Systemtic Name: ethyl 4-[(3-thiophen-2-ylquinoxalin-2-yl)amino]benzoate Openeye Name: ethyl 4-[[3-(2-thienyl)quinoxalin-2-yl]amino]benzoate CAS Name: 4-[(3-thiophen-2-yl-2-quinoxalinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-thiophen-2-ylquinoxalin-2-yl)amino]benzoate Traditional Name: 4-[[3-(2-thienyl)quinoxalin-2-yl]amino]benzoic acid ethyl ester Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2C4=CC=CS4

InChI

InChI=1S/C21H17N3O2S/c1-2-26-21(25)14-9-11-15(12-10-14)22-20-19(18-8-5-13-27-18)23-16-6-3-4-7-17(16)24-20/h3-13H,2H2,1H3,(H,22,24)