2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H17N5O2S2 MolecularWeight: 459.54338

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCN3C(=O)C4=CC=CC=C4N=N3)SC=C2C5=CC=CC=C5

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCN3C(=O)C4=CC=CC=C4N=N3)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C23H17N5O2S2/c1-2-12-27-22(30)19-17(15-8-4-3-5-9-15)13-31-20(19)24-23(27)32-14-28-21(29)16-10-6-7-11-18(16)25-26-28/h2-11,13H,1,12,14H2