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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C14H17N3O2S/c18-12(16-6-3-1-2-4-7-16)9-17-10-15-13-11(14(17)19)5-8-20-13/h5,8,10H,1-4,6-7,9H2