1-[4-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one

Systemtic Name: 1-[4-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one Openeye Name: 1-[4-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one CAS Name: 1-[4-(2-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-1-heptanone IUPAC Name: 1-[4-(2-ethyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one Traditional Name: 1-[4-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazino]heptan-1-one Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)CC)C)C

Isomeric SMILES

CCCCCCC(=O)N1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)CC)C)C

InChI

InChI=1S/C21H32N4OS/c1-5-7-8-9-10-18(26)24-11-13-25(14-12-24)20-19-15(3)16(4)27-21(19)23-17(6-2)22-20/h5-14H2,1-4H3