ethyl 2-(2,3-dihydroindol-1-yl)-4-(thiophen-2-ylmethylamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(2,3-dihydroindol-1-yl)-4-(thiophen-2-ylmethylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 2-indolin-1-yl-4-(2-thienylmethylamino)pyrimidine-5-carboxylate CAS Name: 2-(2,3-dihydroindol-1-yl)-4-(thiophen-2-ylmethylamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,3-dihydroindol-1-yl)-4-(thiophen-2-ylmethylamino)pyrimidine-5-carboxylate Traditional Name: 2-indolin-1-yl-4-(2-thenylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCC2=CC=CS2)N3CCC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCC2=CC=CS2)N3CCC4=CC=CC=C43

InChI

InChI=1S/C20H20N4O2S/c1-2-26-19(25)16-13-22-20(23-18(16)21-12-15-7-5-11-27-15)24-10-9-14-6-3-4-8-17(14)24/h3-8,11,13H,2,9-10,12H2,1H3,(H,21,22,23)