7-(6-morpholin-4-ylpyridin-3-yl)-N5-(thiophen-2-ylmethyl)pyrido[2,3-d]pyrimidine-4,5-diamine

Systemtic Name: 7-(6-morpholin-4-ylpyridin-3-yl)-N5-(thiophen-2-ylmethyl)pyrido[2,3-d]pyrimidine-4,5-diamine Openeye Name: 7-(6-morpholino-3-pyridyl)-N5-(2-thienylmethyl)pyrido[2,3-d]pyrimidine-4,5-diamine CAS Name: 7-[6-(4-morpholinyl)-3-pyridinyl]-N5-(thiophen-2-ylmethyl)pyrido[2,3-d]pyrimidine-4,5-diamine IUPAC Name: 7-(6-morpholin-4-ylpyridin-3-yl)-5-N-(thiophen-2-ylmethyl)pyrido[2,3-d]pyrimidine-4,5-diamine Traditional Name: [4-amino-7-(6-morpholino-3-pyridyl)pyrido[2,3-d]pyrimidin-5-yl]-(2-thenyl)amine Formula: C21H21N7OS MolecularWeight: 419.50274

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C3=NC4=C(C(=C3)NCC5=CC=CS5)C(=NC=N4)N

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C3=NC4=C(C(=C3)NCC5=CC=CS5)C(=NC=N4)N

InChI

InChI=1S/C21H21N7OS/c22-20-19-17(23-12-15-2-1-9-30-15)10-16(27-21(19)26-13-25-20)14-3-4-18(24-11-14)28-5-7-29-8-6-28/h1-4,9-11,13H,5-8,12H2,(H3,22,23,25,26,27)