1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(pyrimidin-2-ylamino)butan-1-one

Systemtic Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(pyrimidin-2-ylamino)butan-1-one Openeye Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(pyrimidin-2-ylamino)butan-1-one CAS Name: 1-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-4-(2-pyrimidinylamino)-1-butanone IUPAC Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(pyrimidin-2-ylamino)butan-1-one Traditional Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-4-(2-pyrimidylamino)butan-1-one Formula: C20H25N7OS MolecularWeight: 411.5238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCNC4=NC=CC=N4

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCNC4=NC=CC=N4

InChI

InChI=1S/C20H25N7OS/c1-2-15-13-16-18(24-14-25-19(16)29-15)27-11-9-26(10-12-27)17(28)5-3-6-21-20-22-7-4-8-23-20/h4,7-8,13-14H,2-3,5-6,9-12H2,1H3,(H,21,22,23)