3-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(azocan-1-yl)-2-oxo-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1-azocanyl)-2-oxoethyl]-6-ethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(azocan-1-yl)-2-oxoethyl]-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(azocan-1-yl)-2-keto-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)N3CCCCCCC3

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)N3CCCCCCC3

InChI

InChI=1S/C17H23N3O2S/c1-2-13-10-14-16(23-13)18-12-20(17(14)22)11-15(21)19-8-6-4-3-5-7-9-19/h10,12H,2-9,11H2,1H3