[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-isoquinolin-1-yl-methanone

Systemtic Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-isoquinolin-1-yl-methanone Openeye Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-(1-isoquinolyl)methanone CAS Name: [4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-(1-isoquinolinyl)methanone IUPAC Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-isoquinolin-1-ylmethanone Traditional Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-(1-isoquinolyl)methanone Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C22H21N5OS/c1-2-16-13-18-20(24-14-25-21(18)29-16)26-9-11-27(12-10-26)22(28)19-17-6-4-3-5-15(17)7-8-23-19/h3-8,13-14H,2,9-12H2,1H3