1-[4-[6-ethyl-2-(3-oxidanylpropylamino)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[4-[6-ethyl-2-(3-oxidanylpropylamino)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-[6-ethyl-2-(3-hydroxypropylamino)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-[6-ethyl-2-(3-hydroxypropylamino)-4-thieno[2,3-d]pyrimidinyl]-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-[6-ethyl-2-(3-hydroxypropylamino)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-[6-ethyl-2-(3-hydroxypropylamino)thieno[2,3-d]pyrimidin-4-yl]piperazino]-2-phenyl-ethanone Formula: C23H29N5O2S MolecularWeight: 439.57366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)NCCCO)N3CCN(CC3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)NCCCO)N3CCN(CC3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N5O2S/c1-2-18-16-19-21(25-23(24-9-6-14-29)26-22(19)31-18)28-12-10-27(11-13-28)20(30)15-17-7-4-3-5-8-17/h3-5,7-8,16,29H,2,6,9-15H2,1H3,(H,24,25,26)