ethyl 5-methyl-2-[phenethyl-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbonyl-amino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-2-[phenethyl-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbonyl-amino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(1-isopropylpyrazolo[3,4-b]pyridine-5-carbonyl)-phenethyl-amino]-5-methyl-thiazole-4-carboxylate CAS Name: 5-methyl-2-[[oxo-(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)methyl]-phenethylamino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[phenethyl-(1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carbonyl)amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(1-isopropylpyrazolo[3,4-b]pyridine-5-carbonyl)-phenethyl-amino]-5-methyl-thiazole-4-carboxylic acid ethyl ester Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=N1)N(CCC2=CC=CC=C2)C(=O)C3=CN=C4C(=C3)C=NN4C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=N1)N(CCC2=CC=CC=C2)C(=O)C3=CN=C4C(=C3)C=NN4C(C)C)C

InChI

InChI=1S/C25H27N5O3S/c1-5-33-24(32)21-17(4)34-25(28-21)29(12-11-18-9-7-6-8-10-18)23(31)20-13-19-15-27-30(16(2)3)22(19)26-14-20/h6-10,13-16H,5,11-12H2,1-4H3