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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-6-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-6-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-6-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N=CN(C2=O)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC2=C(S1)N=CN(C2=O)CC(=O)N3CCCCCC3

InChI

InChI=1S/C15H19N3O2S/c1-11-8-12-14(21-11)16-10-18(15(12)20)9-13(19)17-6-4-2-3-5-7-17/h8,10H,2-7,9H2,1H3