1-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-2-phenoxy-ethanone Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C(=O)COC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C(=O)COC4=CC=CC=C4)C

InChI

InChI=1S/C20H22N4O2S/c1-14-15(2)27-20-18(14)19(21-13-22-20)24-10-8-23(9-11-24)17(25)12-26-16-6-4-3-5-7-16/h3-7,13H,8-12H2,1-2H3