ethyl 4-phenyl-2-[(3-piperidin-1-ylquinoxalin-2-yl)amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[(3-piperidin-1-ylquinoxalin-2-yl)amino]thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[3-(1-piperidyl)quinoxalin-2-yl]amino]thiophene-3-carboxylate CAS Name: 4-phenyl-2-[[3-(1-piperidinyl)-2-quinoxalinyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[(3-piperidin-1-ylquinoxalin-2-yl)amino]thiophene-3-carboxylate Traditional Name: 4-phenyl-2-[(3-piperidinoquinoxalin-2-yl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3=NC4=CC=CC=C4N=C3N5CCCCC5

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3=NC4=CC=CC=C4N=C3N5CCCCC5

InChI

InChI=1S/C26H26N4O2S/c1-2-32-26(31)22-19(18-11-5-3-6-12-18)17-33-25(22)29-23-24(30-15-9-4-10-16-30)28-21-14-8-7-13-20(21)27-23/h3,5-8,11-14,17H,2,4,9-10,15-16H2,1H3,(H,27,29)