(4-azanylquinazolin-2-yl)methyl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate CAS Name: 1-(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinecarboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate Traditional Name: 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)isonipecotic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C23H24N6O2S MolecularWeight: 448.54066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N)C

InChI

InChI=1S/C23H24N6O2S/c1-13-14(2)32-22-19(13)21(25-12-26-22)29-9-7-15(8-10-29)23(30)31-11-18-27-17-6-4-3-5-16(17)20(24)28-18/h3-6,12,15H,7-11H2,1-2H3,(H2,24,27,28)