ethyl 4,5-dimethyl-2-[(3-morpholin-4-ylquinoxalin-2-yl)amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[(3-morpholin-4-ylquinoxalin-2-yl)amino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(3-morpholinoquinoxalin-2-yl)amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[3-(4-morpholinyl)-2-quinoxalinyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(3-morpholin-4-ylquinoxalin-2-yl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(3-morpholinoquinoxalin-2-yl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2N4CCOCC4

InChI

InChI=1S/C21H24N4O3S/c1-4-28-21(26)17-13(2)14(3)29-20(17)24-18-19(25-9-11-27-12-10-25)23-16-8-6-5-7-15(16)22-18/h5-8H,4,9-12H2,1-3H3,(H,22,24)