(6-methoxythieno[2,3-b]quinolin-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (6-methoxythieno[2,3-b]quinolin-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (6-methoxythieno[2,3-b]quinolin-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (6-methoxy-2-thieno[2,3-b]quinolinyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (6-methoxythieno[2,3-b]quinolin-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (6-methoxythieno[2,3-b]quinolin-2-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=C(N=C2C=C1)SC(=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

COC1=CC2=CC3=C(N=C2C=C1)SC(=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C21H19N5O2S/c1-28-16-3-4-17-14(12-16)11-15-13-18(29-19(15)24-17)20(27)25-7-9-26(10-8-25)21-22-5-2-6-23-21/h2-6,11-13H,7-10H2,1H3