2-[[2-(4-isoquinolin-1-ylpiperazin-1-yl)-5-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]-3-methyl-butan-1-ol

Systemtic Name: 2-[[2-(4-isoquinolin-1-ylpiperazin-1-yl)-5-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]-3-methyl-butan-1-ol Openeye Name: 2-[[2-[4-(1-isoquinolyl)piperazin-1-yl]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]-3-methyl-butan-1-ol CAS Name: 2-[[2-[4-(1-isoquinolinyl)-1-piperazinyl]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]-3-methyl-1-butanol IUPAC Name: 2-[[2-(4-isoquinolin-1-ylpiperazin-1-yl)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]-3-methylbutan-1-ol Traditional Name: 2-[[2-[4-(1-isoquinolyl)piperazino]-5-keto-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]-3-methyl-butan-1-ol Formula: C24H30N6O2S MolecularWeight: 466.599

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)NC1=NC(=NC2=C1S(=O)CC2)N3CCN(CC3)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)C(CO)NC1=NC(=NC2=C1S(=O)CC2)N3CCN(CC3)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C24H30N6O2S/c1-16(2)20(15-31)26-22-21-19(8-14-33(21)32)27-24(28-22)30-12-10-29(11-13-30)23-18-6-4-3-5-17(18)7-9-25-23/h3-7,9,16,20,31H,8,10-15H2,1-2H3,(H,26,27,28)