3,5,6-trimethyl-2-(2-oxidanylidenecycloheptyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3,5,6-trimethyl-2-(2-oxidanylidenecycloheptyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3,5,6-trimethyl-2-(2-oxocycloheptyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3,5,6-trimethyl-2-[(2-oxocycloheptyl)thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3,5,6-trimethyl-2-(2-oxocycloheptyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-ketocycloheptyl)thio]-3,5,6-trimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC3CCCCCC3=O)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC3CCCCCC3=O)C)C

InChI

InChI=1S/C16H20N2O2S2/c1-9-10(2)21-14-13(9)15(20)18(3)16(17-14)22-12-8-6-4-5-7-11(12)19/h12H,4-8H2,1-3H3