4-[2-isoquinolin-4-yl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[2-isoquinolin-4-yl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine Openeye Name: 4-[2-(4-isoquinolyl)-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine CAS Name: 4-[2-(4-isoquinolinyl)-6-[(4-methylsulfonyl-1-piperazinyl)methyl]-4-thieno[3,2-d]pyrimidinyl]morpholine IUPAC Name: 4-[2-isoquinolin-4-yl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine Traditional Name: 4-[2-(4-isoquinolyl)-6-[(4-mesylpiperazino)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine Formula: C25H28N6O3S2 MolecularWeight: 524.65822

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC3=C(S2)C(=NC(=N3)C4=CN=CC5=CC=CC=C54)N6CCOCC6

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC3=C(S2)C(=NC(=N3)C4=CN=CC5=CC=CC=C54)N6CCOCC6

InChI

InChI=1S/C25H28N6O3S2/c1-36(32,33)31-8-6-29(7-9-31)17-19-14-22-23(35-19)25(30-10-12-34-13-11-30)28-24(27-22)21-16-26-15-18-4-2-3-5-20(18)21/h2-5,14-16H,6-13,17H2,1H3