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

Systemtic Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-isoquinolin-3-yl-methanone Openeye Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-(3-isoquinolyl)methanone CAS Name: [4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-(3-isoquinolinyl)methanone IUPAC Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-isoquinolin-3-ylmethanone Traditional Name: [4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-(3-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=CC5=CC=CC=C5C=N4

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5C=N4

InChI

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