7-methyl-3-[(3S)-2-oxidanylideneazepan-3-yl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 7-methyl-3-[(3S)-2-oxidanylideneazepan-3-yl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 7-methyl-3-[(3S)-2-oxoazepan-3-yl]thieno[3,2-d]pyrimidin-4-one CAS Name: 7-methyl-3-[(3S)-2-oxo-3-azepanyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 7-methyl-3-[(3S)-2-oxoazepan-3-yl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[(3S)-2-ketoazepan-3-yl]-7-methyl-thieno[3,2-d]pyrimidin-4-one Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1N=CN(C2=O)C3CCCCNC3=O

Isomeric SMILES

CC1=CSC2=C1N=CN(C2=O)[C@H]3CCCCNC3=O

InChI

InChI=1S/C13H15N3O2S/c1-8-6-19-11-10(8)15-7-16(13(11)18)9-4-2-3-5-14-12(9)17/h6-7,9H,2-5H2,1H3,(H,14,17)/t9-/m0/s1