3-cyclohexyl-5-cyclopropyl-2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-cyclohexyl-5-cyclopropyl-2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-cyclohexyl-5-cyclopropyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-cyclohexyl-5-cyclopropyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-cyclohexyl-5-cyclopropyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-cyclohexyl-5-cyclopropyl-2-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C23H23N5O2S2 MolecularWeight: 465.59102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(N=C2SCN4C(=O)C5=CC=CC=C5N=N4)SC=C3C6CC6

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(N=C2SCN4C(=O)C5=CC=CC=C5N=N4)SC=C3C6CC6

InChI

InChI=1S/C23H23N5O2S2/c29-21-16-8-4-5-9-18(16)25-26-27(21)13-32-23-24-20-19(17(12-31-20)14-10-11-14)22(30)28(23)15-6-2-1-3-7-15/h4-5,8-9,12,14-15H,1-3,6-7,10-11,13H2