3-ethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-[(4-keto-1H-quinazolin-2-yl)methylthio]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H16N4O2S3 MolecularWeight: 452.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=NC(=O)C4=CC=CC=C4N3)SC=C2C5=CC=CS5

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=NC(=O)C4=CC=CC=C4N3)SC=C2C5=CC=CS5

InChI

InChI=1S/C21H16N4O2S3/c1-2-25-20(27)17-13(15-8-5-9-28-15)10-29-19(17)24-21(25)30-11-16-22-14-7-4-3-6-12(14)18(26)23-16/h3-10H,2,11H2,1H3,(H,22,23,26)