3-cyclopentyl-5,6-dimethyl-2-(2-oxidanylideneazepan-3-yl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-cyclopentyl-5,6-dimethyl-2-(2-oxidanylideneazepan-3-yl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-cyclopentyl-5,6-dimethyl-2-(2-oxoazepan-3-yl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-cyclopentyl-5,6-dimethyl-2-[(2-oxo-3-azepanyl)thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-cyclopentyl-5,6-dimethyl-2-(2-oxoazepan-3-yl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-cyclopentyl-2-[(2-ketoazepan-3-yl)thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H25N3O2S2 MolecularWeight: 391.5507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC3CCCCNC3=O)C4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC3CCCCNC3=O)C4CCCC4)C

InChI

InChI=1S/C19H25N3O2S2/c1-11-12(2)25-17-15(11)18(24)22(13-7-3-4-8-13)19(21-17)26-14-9-5-6-10-20-16(14)23/h13-14H,3-10H2,1-2H3,(H,20,23)